{
  "fields": [{"id":"_id","type":"int"},{"id":"labels","type":"numeric"},{"id":"smiles","type":"text"},{"id":"0","type":"numeric"},{"id":"1","type":"numeric"},{"id":"2","type":"numeric"},{"id":"3","type":"numeric"},{"id":"4","type":"numeric"},{"id":"5","type":"numeric"},{"id":"6","type":"numeric"},{"id":"7","type":"numeric"},{"id":"8","type":"numeric"},{"id":"9","type":"numeric"},{"id":"10","type":"numeric"},{"id":"11","type":"numeric"},{"id":"12","type":"numeric"},{"id":"13","type":"numeric"},{"id":"14","type":"numeric"},{"id":"15","type":"numeric"},{"id":"16","type":"numeric"},{"id":"17","type":"numeric"},{"id":"18","type":"numeric"},{"id":"19","type":"numeric"},{"id":"20","type":"numeric"},{"id":"21","type":"numeric"},{"id":"22","type":"numeric"},{"id":"23","type":"numeric"},{"id":"24","type":"numeric"},{"id":"25","type":"numeric"},{"id":"26","type":"numeric"},{"id":"27","type":"numeric"},{"id":"28","type":"numeric"},{"id":"29","type":"numeric"},{"id":"30","type":"numeric"},{"id":"31","type":"numeric"},{"id":"32","type":"numeric"},{"id":"33","type":"numeric"},{"id":"34","type":"numeric"},{"id":"35","type":"numeric"},{"id":"36","type":"numeric"},{"id":"37","type":"numeric"},{"id":"38","type":"numeric"},{"id":"39","type":"numeric"},{"id":"40","type":"numeric"},{"id":"41","type":"numeric"},{"id":"42","type":"numeric"},{"id":"43","type":"numeric"},{"id":"44","type":"numeric"},{"id":"45","type":"numeric"},{"id":"46","type":"numeric"},{"id":"47","type":"numeric"},{"id":"48","type":"numeric"},{"id":"49","type":"numeric"},{"id":"50","type":"numeric"},{"id":"51","type":"numeric"},{"id":"52","type":"numeric"},{"id":"53","type":"numeric"},{"id":"54","type":"numeric"},{"id":"55","type":"numeric"},{"id":"56","type":"numeric"},{"id":"57","type":"numeric"},{"id":"58","type":"numeric"},{"id":"59","type":"numeric"},{"id":"60","type":"numeric"},{"id":"61","type":"numeric"},{"id":"62","type":"numeric"},{"id":"63","type":"numeric"},{"id":"64","type":"numeric"},{"id":"65","type":"numeric"},{"id":"66","type":"numeric"},{"id":"67","type":"numeric"},{"id":"68","type":"numeric"},{"id":"69","type":"numeric"},{"id":"70","type":"numeric"},{"id":"71","type":"numeric"},{"id":"72","type":"numeric"},{"id":"73","type":"numeric"},{"id":"74","type":"numeric"},{"id":"75","type":"numeric"},{"id":"76","type":"numeric"},{"id":"77","type":"numeric"},{"id":"78","type":"numeric"},{"id":"79","type":"numeric"},{"id":"80","type":"numeric"},{"id":"81","type":"numeric"},{"id":"82","type":"numeric"},{"id":"83","type":"numeric"},{"id":"84","type":"numeric"},{"id":"85","type":"numeric"},{"id":"86","type":"numeric"},{"id":"87","type":"numeric"},{"id":"88","type":"numeric"},{"id":"89","type":"numeric"},{"id":"90","type":"numeric"},{"id":"91","type":"numeric"},{"id":"92","type":"numeric"},{"id":"93","type":"numeric"},{"id":"94","type":"numeric"},{"id":"95","type":"numeric"},{"id":"96","type":"numeric"},{"id":"97","type":"numeric"},{"id":"98","type":"numeric"},{"id":"99","type":"numeric"},{"id":"100","type":"numeric"},{"id":"101","type":"numeric"},{"id":"102","type":"numeric"},{"id":"103","type":"numeric"},{"id":"104","type":"numeric"},{"id":"105","type":"numeric"},{"id":"106","type":"numeric"},{"id":"107","type":"numeric"},{"id":"108","type":"numeric"},{"id":"109","type":"numeric"},{"id":"110","type":"numeric"},{"id":"111","type":"numeric"},{"id":"112","type":"numeric"},{"id":"113","type":"numeric"},{"id":"114","type":"numeric"},{"id":"115","type":"numeric"},{"id":"116","type":"numeric"},{"id":"117","type":"numeric"},{"id":"118","type":"numeric"},{"id":"119","type":"numeric"},{"id":"120","type":"numeric"},{"id":"121","type":"numeric"},{"id":"122","type":"numeric"},{"id":"123","type":"numeric"},{"id":"124","type":"numeric"},{"id":"125","type":"numeric"},{"id":"126","type":"numeric"},{"id":"127","type":"numeric"},{"id":"128","type":"numeric"},{"id":"129","type":"numeric"},{"id":"130","type":"numeric"},{"id":"131","type":"numeric"},{"id":"132","type":"numeric"},{"id":"133","type":"numeric"},{"id":"134","type":"numeric"},{"id":"135","type":"numeric"},{"id":"136","type":"numeric"},{"id":"137","type":"numeric"},{"id":"138","type":"numeric"},{"id":"139","type":"numeric"},{"id":"140","type":"numeric"},{"id":"141","type":"numeric"},{"id":"142","type":"numeric"},{"id":"143","type":"numeric"},{"id":"144","type":"numeric"},{"id":"145","type":"numeric"},{"id":"146","type":"numeric"},{"id":"147","type":"numeric"},{"id":"148","type":"numeric"},{"id":"149","type":"numeric"},{"id":"150","type":"numeric"},{"id":"151","type":"numeric"},{"id":"152","type":"numeric"},{"id":"153","type":"numeric"},{"id":"154","type":"numeric"},{"id":"155","type":"numeric"},{"id":"156","type":"numeric"},{"id":"157","type":"numeric"},{"id":"158","type":"numeric"},{"id":"159","type":"numeric"},{"id":"160","type":"numeric"},{"id":"161","type":"numeric"},{"id":"162","type":"numeric"},{"id":"163","type":"numeric"},{"id":"164","type":"numeric"},{"id":"165","type":"numeric"},{"id":"166","type":"numeric"},{"id":"167","type":"numeric"},{"id":"168","type":"numeric"},{"id":"169","type":"numeric"},{"id":"170","type":"numeric"},{"id":"171","type":"numeric"},{"id":"172","type":"numeric"},{"id":"173","type":"numeric"},{"id":"174","type":"numeric"},{"id":"175","type":"numeric"},{"id":"176","type":"numeric"},{"id":"177","type":"numeric"},{"id":"178","type":"numeric"},{"id":"179","type":"numeric"},{"id":"180","type":"numeric"},{"id":"181","type":"numeric"},{"id":"182","type":"numeric"},{"id":"183","type":"numeric"},{"id":"184","type":"numeric"},{"id":"185","type":"numeric"},{"id":"186","type":"numeric"},{"id":"187","type":"numeric"},{"id":"188","type":"numeric"},{"id":"189","type":"numeric"},{"id":"190","type":"numeric"},{"id":"191","type":"numeric"},{"id":"192","type":"numeric"},{"id":"193","type":"numeric"},{"id":"194","type":"numeric"},{"id":"195","type":"numeric"},{"id":"196","type":"numeric"},{"id":"197","type":"numeric"},{"id":"198","type":"numeric"},{"id":"199","type":"numeric"},{"id":"200","type":"numeric"},{"id":"201","type":"numeric"},{"id":"202","type":"numeric"},{"id":"203","type":"numeric"},{"id":"204","type":"numeric"},{"id":"205","type":"numeric"},{"id":"206","type":"numeric"},{"id":"207","type":"numeric"},{"id":"208","type":"numeric"},{"id":"209","type":"numeric"},{"id":"210","type":"numeric"},{"id":"211","type":"numeric"},{"id":"212","type":"numeric"},{"id":"213","type":"numeric"},{"id":"214","type":"numeric"},{"id":"215","type":"numeric"},{"id":"216","type":"numeric"},{"id":"217","type":"numeric"},{"id":"218","type":"numeric"},{"id":"219","type":"numeric"},{"id":"220","type":"numeric"},{"id":"221","type":"numeric"},{"id":"222","type":"numeric"},{"id":"223","type":"numeric"},{"id":"224","type":"numeric"},{"id":"225","type":"numeric"},{"id":"226","type":"numeric"},{"id":"227","type":"numeric"},{"id":"228","type":"numeric"},{"id":"229","type":"numeric"},{"id":"230","type":"numeric"},{"id":"231","type":"numeric"},{"id":"232","type":"numeric"},{"id":"233","type":"numeric"},{"id":"234","type":"numeric"},{"id":"235","type":"numeric"},{"id":"236","type":"numeric"},{"id":"237","type":"numeric"},{"id":"238","type":"numeric"},{"id":"239","type":"numeric"},{"id":"240","type":"numeric"},{"id":"241","type":"numeric"},{"id":"242","type":"numeric"},{"id":"243","type":"numeric"},{"id":"244","type":"numeric"},{"id":"245","type":"numeric"},{"id":"246","type":"numeric"},{"id":"247","type":"numeric"},{"id":"248","type":"numeric"},{"id":"249","type":"numeric"},{"id":"250","type":"numeric"},{"id":"251","type":"numeric"},{"id":"252","type":"numeric"},{"id":"253","type":"numeric"},{"id":"254","type":"numeric"},{"id":"255","type":"numeric"},{"id":"256","type":"numeric"},{"id":"257","type":"numeric"},{"id":"258","type":"numeric"},{"id":"259","type":"numeric"},{"id":"260","type":"numeric"},{"id":"261","type":"numeric"},{"id":"262","type":"numeric"},{"id":"263","type":"numeric"},{"id":"264","type":"numeric"},{"id":"265","type":"numeric"},{"id":"266","type":"numeric"},{"id":"267","type":"numeric"},{"id":"268","type":"numeric"},{"id":"269","type":"numeric"},{"id":"270","type":"numeric"},{"id":"271","type":"numeric"},{"id":"272","type":"numeric"},{"id":"273","type":"numeric"},{"id":"274","type":"numeric"},{"id":"275","type":"numeric"},{"id":"276","type":"numeric"},{"id":"277","type":"numeric"},{"id":"278","type":"numeric"},{"id":"279","type":"numeric"},{"id":"280","type":"numeric"},{"id":"281","type":"numeric"},{"id":"282","type":"numeric"},{"id":"283","type":"numeric"},{"id":"284","type":"numeric"},{"id":"285","type":"numeric"},{"id":"286","type":"numeric"},{"id":"287","type":"numeric"},{"id":"288","type":"numeric"},{"id":"289","type":"numeric"},{"id":"290","type":"numeric"},{"id":"291","type":"numeric"},{"id":"292","type":"numeric"},{"id":"293","type":"numeric"},{"id":"294","type":"numeric"},{"id":"295","type":"numeric"},{"id":"296","type":"numeric"},{"id":"297","type":"numeric"},{"id":"298","type":"numeric"},{"id":"299","type":"numeric"},{"id":"300","type":"numeric"},{"id":"301","type":"numeric"},{"id":"302","type":"numeric"},{"id":"303","type":"numeric"},{"id":"304","type":"numeric"},{"id":"305","type":"numeric"},{"id":"306","type":"numeric"},{"id":"307","type":"numeric"},{"id":"308","type":"numeric"},{"id":"309","type":"numeric"},{"id":"310","type":"numeric"},{"id":"311","type":"numeric"},{"id":"312","type":"numeric"},{"id":"313","type":"numeric"},{"id":"314","type":"numeric"},{"id":"315","type":"numeric"},{"id":"316","type":"numeric"},{"id":"317","type":"numeric"},{"id":"318","type":"numeric"},{"id":"319","type":"numeric"},{"id":"320","type":"numeric"},{"id":"321","type":"numeric"},{"id":"322","type":"numeric"},{"id":"323","type":"numeric"},{"id":"324","type":"numeric"},{"id":"325","type":"numeric"},{"id":"326","type":"numeric"},{"id":"327","type":"numeric"},{"id":"328","type":"numeric"},{"id":"329","type":"numeric"},{"id":"330","type":"numeric"},{"id":"331","type":"numeric"},{"id":"332","type":"numeric"},{"id":"333","type":"numeric"},{"id":"334","type":"numeric"},{"id":"335","type":"numeric"},{"id":"336","type":"numeric"},{"id":"337","type":"numeric"},{"id":"338","type":"numeric"},{"id":"339","type":"numeric"},{"id":"340","type":"numeric"},{"id":"341","type":"numeric"},{"id":"342","type":"numeric"},{"id":"343","type":"numeric"},{"id":"344","type":"numeric"},{"id":"345","type":"numeric"},{"id":"346","type":"numeric"},{"id":"347","type":"numeric"},{"id":"348","type":"numeric"},{"id":"349","type":"numeric"},{"id":"350","type":"numeric"},{"id":"351","type":"numeric"},{"id":"352","type":"numeric"},{"id":"353","type":"numeric"},{"id":"354","type":"numeric"},{"id":"355","type":"numeric"},{"id":"356","type":"numeric"},{"id":"357","type":"numeric"},{"id":"358","type":"numeric"},{"id":"359","type":"numeric"},{"id":"360","type":"numeric"},{"id":"361","type":"numeric"},{"id":"362","type":"numeric"},{"id":"363","type":"numeric"},{"id":"364","type":"numeric"},{"id":"365","type":"numeric"},{"id":"366","type":"numeric"},{"id":"367","type":"numeric"},{"id":"368","type":"numeric"},{"id":"369","type":"numeric"},{"id":"370","type":"numeric"},{"id":"371","type":"numeric"},{"id":"372","type":"numeric"},{"id":"373","type":"numeric"},{"id":"374","type":"numeric"},{"id":"375","type":"numeric"},{"id":"376","type":"numeric"},{"id":"377","type":"numeric"},{"id":"378","type":"numeric"},{"id":"379","type":"numeric"},{"id":"380","type":"numeric"},{"id":"381","type":"numeric"},{"id":"382","type":"numeric"},{"id":"383","type":"numeric"},{"id":"384","type":"numeric"},{"id":"385","type":"numeric"},{"id":"386","type":"numeric"},{"id":"387","type":"numeric"},{"id":"388","type":"numeric"},{"id":"389","type":"numeric"},{"id":"390","type":"numeric"},{"id":"391","type":"numeric"},{"id":"392","type":"numeric"},{"id":"393","type":"numeric"},{"id":"394","type":"numeric"},{"id":"395","type":"numeric"},{"id":"396","type":"numeric"},{"id":"397","type":"numeric"},{"id":"398","type":"numeric"},{"id":"399","type":"numeric"},{"id":"400","type":"numeric"},{"id":"401","type":"numeric"},{"id":"402","type":"numeric"},{"id":"403","type":"numeric"},{"id":"404","type":"numeric"},{"id":"405","type":"numeric"},{"id":"406","type":"numeric"},{"id":"407","type":"numeric"},{"id":"408","type":"numeric"},{"id":"409","type":"numeric"},{"id":"410","type":"numeric"},{"id":"411","type":"numeric"},{"id":"412","type":"numeric"},{"id":"413","type":"numeric"},{"id":"414","type":"numeric"},{"id":"415","type":"numeric"},{"id":"416","type":"numeric"},{"id":"417","type":"numeric"},{"id":"418","type":"numeric"},{"id":"419","type":"numeric"},{"id":"420","type":"numeric"},{"id":"421","type":"numeric"},{"id":"422","type":"numeric"},{"id":"423","type":"numeric"},{"id":"424","type":"numeric"},{"id":"425","type":"numeric"},{"id":"426","type":"numeric"},{"id":"427","type":"numeric"},{"id":"428","type":"numeric"},{"id":"429","type":"numeric"},{"id":"430","type":"numeric"},{"id":"431","type":"numeric"},{"id":"432","type":"numeric"},{"id":"433","type":"numeric"},{"id":"434","type":"numeric"},{"id":"435","type":"numeric"},{"id":"436","type":"numeric"},{"id":"437","type":"numeric"},{"id":"438","type":"numeric"},{"id":"439","type":"numeric"},{"id":"440","type":"numeric"},{"id":"441","type":"numeric"},{"id":"442","type":"numeric"},{"id":"443","type":"numeric"},{"id":"444","type":"numeric"},{"id":"445","type":"numeric"},{"id":"446","type":"numeric"},{"id":"447","type":"numeric"},{"id":"448","type":"numeric"},{"id":"449","type":"numeric"},{"id":"450","type":"numeric"},{"id":"451","type":"numeric"},{"id":"452","type":"numeric"},{"id":"453","type":"numeric"},{"id":"454","type":"numeric"},{"id":"455","type":"numeric"},{"id":"456","type":"numeric"},{"id":"457","type":"numeric"},{"id":"458","type":"numeric"},{"id":"459","type":"numeric"},{"id":"460","type":"numeric"},{"id":"461","type":"numeric"},{"id":"462","type":"numeric"},{"id":"463","type":"numeric"},{"id":"464","type":"numeric"},{"id":"465","type":"numeric"},{"id":"466","type":"numeric"},{"id":"467","type":"numeric"},{"id":"468","type":"numeric"},{"id":"469","type":"numeric"},{"id":"470","type":"numeric"},{"id":"471","type":"numeric"},{"id":"472","type":"numeric"},{"id":"473","type":"numeric"},{"id":"474","type":"numeric"},{"id":"475","type":"numeric"},{"id":"476","type":"numeric"},{"id":"477","type":"numeric"},{"id":"478","type":"numeric"},{"id":"479","type":"numeric"},{"id":"480","type":"numeric"},{"id":"481","type":"numeric"},{"id":"482","type":"numeric"},{"id":"483","type":"numeric"},{"id":"484","type":"numeric"},{"id":"485","type":"numeric"},{"id":"486","type":"numeric"},{"id":"487","type":"numeric"},{"id":"488","type":"numeric"},{"id":"489","type":"numeric"},{"id":"490","type":"numeric"},{"id":"491","type":"numeric"},{"id":"492","type":"numeric"},{"id":"493","type":"numeric"},{"id":"494","type":"numeric"},{"id":"495","type":"numeric"},{"id":"496","type":"numeric"},{"id":"497","type":"numeric"},{"id":"498","type":"numeric"},{"id":"499","type":"numeric"},{"id":"500","type":"numeric"},{"id":"501","type":"numeric"},{"id":"502","type":"numeric"},{"id":"503","type":"numeric"},{"id":"504","type":"numeric"},{"id":"505","type":"numeric"},{"id":"506","type":"numeric"},{"id":"507","type":"numeric"},{"id":"508","type":"numeric"},{"id":"509","type":"numeric"},{"id":"510","type":"numeric"},{"id":"511","type":"numeric"}],
  "records": [
    [1,1,"O=C(O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]",-0.31612256,0.12005827,-0.7489169,0.25722688,-0.17087904,-0.72545046,-0.46322754,-0.1238458,0.45653206,0.518747,0.12614541,0.70425135,-0.38697237,0.8289166,0.01300771,-0.73429036,0.019917866,0.62008464,0.59788233,0.30390233,0.5364503,0.3276878,0.00032362,0.38843468,0.15989853,-0.46221006,0.31141996,0.30274197,-0.12565199,-0.42761585,-0.31100625,0.6160367,0.21979459,0.09822853,0.17707093,-0.3289744,-0.07599505,0.70926994,0.9984983,-0.28450084,-0.872434,-0.28337315,-0.11015971,0.06923493,-0.19138633,-0.54863167,-0.04057583,0.29258904,0.44234067,0.26970604,0.7125994,0.6830624,-0.72934484,-0.31901705,-0.54530305,-0.11373751,-0.8565378,-0.5154698,0.21007322,0.2637117,-0.113684125,0.6616079,0.3880029,0.5838848,-0.10630604,0.71640944,0.576719,0.27013072,-0.14838941,-0.19556446,-0.6914087,-0.58816594,-0.5643879,-0.8022227,0.12788552,-0.14637952,-0.44725823,-0.12936461,-0.3416357,-0.9983908,0.20040089,-0.3620261,-0.9020151,-0.56627023,0.44612736,-0.9109785,0.083739184,0.28335282,-0.45746833,0.2485858,-0.53466684,0.4360729,-0.24552697,0.6325865,0.99932337,-0.42099157,0.45463818,-0.40901917,-0.46597764,0.14570199,0.3843969,-0.5238481,0.24109699,0.821166,-0.98986214,-0.78007364,0.29944807,-0.21510231,-0.8247321,-0.0496542,-0.14065173,-0.79014665,-0.55489117,-0.7252377,0.64264745,0.47086045,0.45095527,0.49618992,0.9915307,-0.35006875,0.23330124,-0.08231224,-0.5873071,-0.21607389,-0.8249861,0.045500424,0.05365904,-0.4830825,-0.07434952,0.9998438,-0.50829494,-0.07485169,0.7644067,0.1679814,-0.52126807,-0.9425349,0.41350922,0.31586438,-0.52979386,-0.08308991,-0.99969476,0.031035936,0.43954068,-0.5110687,0.3406222,-0.28370258,-0.6841955,-0.3934013,-0.7451232,-0.09694706,-0.2396761,-0.41113433,-0.2274632,-0.3157699,-0.3331452,-0.021318344,-0.71917,-0.01720914,-0.8659911,-0.521528,-0.75542057,0.5657368,0.061078362,-0.39671192,-0.035416897,0.5905946,-0.73774767,-0.036203444,0.05546039,0.42177388,-0.5850442,0.07295098,-0.5355471,0.30448976,0.7782901,-0.9540415,-0.76464695,-0.4344878,-0.48686618,0.49867558,-0.020673934,-0.9928337,-0.77477574,-0.668465,0.068995684,-0.22010045,0.3949161,0.25070614,-0.2754112,-0.38367474,0.10044212,0.455639,-0.41243163,-0.4151094,-0.6261136,-0.13092643,0.7296487,0.7723966,-0.012252169,0.55558234,-0.28130004,-0.2046082,-0.5888636,0.36209458,0.10172894,-0.574878,0.5837827,-0.5164221,-0.37726715,-0.9995267,0.35239643,-0.006266862,-0.059141435,-0.16594301,-0.32618144,0.7312571,-0.04896212,0.32005566,-0.1594887,-0.70998454,-0.23222987,-0.53931594,-0.43860593,0.501529,0.9799141,0.18729588,-0.5571165,0.5623701,0.022824597,0.051194973,-0.77312875,0.18999991,0.42670253,-0.16989726,0.11716429,0.06722225,-0.09016251,0.050506108,0.09853095,-0.34245574,0.7194135,0.06669459,0.7112323,-0.73383915,0.3574639,-0.26465353,0.24269,0.084316224,0.16621134,0.001446375,0.06814367,-0.9763608,-0.020226043,0.36336312,0.15616363,-0.06849715,-0.15215868,0.43660566,-0.2251602,-0.28182095,0.41311643,0.45711467,-0.22857434,-0.4884657,0.31651878,-0.09410546,-0.26795915,0.27787405,0.6138364,0.08369904,0.26962808,0.88942456,0.48690537,-0.010649039,-0.6088905,0.86251885,-0.39967385,-0.47944131,-0.6106369,-0.08959144,0.05946063,0.99672914,-0.4574374,0.66423357,-0.15046138,-0.18073876,-0.05710776,0.27967408,0.47467366,-0.02651432,-0.6253986,0.8807867,0.32710758,0.50841856,-0.22980917,-0.13020085,0.9998934,-0.9882487,-0.60507214,0.70789754,0.3734112,0.21963464,-0.82385665,0.3680532,-0.05765334,-0.34993568,-0.936043,0.2536991,0.6252152,-0.07733639,0.4598505,-0.46723378,-0.49116373,-0.14267063,-0.76579,-0.10990367,0.1908612,0.17870447,-0.95733845,-0.12552477,0.01241538,-0.08218845,0.7493216,-0.8679853,-0.43784365,0.17311898,0.557542,-0.96467644,-0.050163,-0.6607935,0.08422889,-0.47527194,-0.034080792,0.15247801,-0.110287055,0.54036164,0.12126212,0.28611213,-0.07809087,0.79597676,0.74167174,0.56041616,-0.56029975,-0.19073018,0.084169775,0.07699855,0.65927404,0.27238476,-0.4731006,-0.78839236,-0.94090796,0.4767567,-0.27791792,-0.20148209,-0.35912043,0.594366,-0.22052114,0.9995868,0.60057443,0.27253547,-0.3351428,0.08569881,0.52967274,-0.66082585,-0.83765686,0.115683235,0.2102782,-0.49908084,0.42710057,0.45185432,-0.6221154,0.32949147,0.44838816,0.16841447,-0.033786364,0.99545044,-0.06364369,-0.34798557,0.010898523,0.056139078,-0.2845664,-0.6764583,-0.15489581,-0.5578307,-0.11342305,-0.33309716,0.1431276,-0.11908912,-0.36645597,0.6915895,-0.71640694,-0.276097,-0.2634645,-0.10777726,0.43113634,-0.3930943,0.036498114,0.22156502,-0.077389084,-0.14082265,0.8618817,-0.41285446,0.15247668,-0.013455609,0.23285076,-0.5760388,-0.5752746,0.97792673,-0.29463533,0.18090521,0.40838957,0.6678775,0.25485262,0.67166656,0.48917437,0.13419221,0.9999259,0.28041396,-0.9934314,-0.34638166,0.9998036,-0.5731715,-0.47538215,-0.99831414,-0.35813975,-0.38537198,0.67721546,-0.03127526,-0.1597253,-0.22779407,-0.16251265,-0.67834306,0.11547665,0.46034753,0.02104096,-0.10247757,0.3734538,-0.29005352,-0.99998665,0.9974519,-0.45592433,0.515699,-0.2306322,-0.018065358,-0.5494216,-0.6713996,-0.4547005,-0.73525447,-0.6258731,0.53465813,-0.9642682,0.3474439,0.18672816,-0.03985569,0.106472366,0.73646724,0.57177234,0.6710309,-0.99991524,-0.23824714,-0.27921048,-0.19287044,-0.29156888,-0.2199992,-0.6023472,0.831267,-0.42440268,-0.40008765,-0.2202066,-0.18088552,-0.085515045,0.97605294,-0.3988596,0.77063733,0.22788844,-0.4790359,-0.56647146,-0.078737505,-0.14268552,-0.55026585,-0.21845502,0.024840493,0.05816243,0.66941166,0.093454614,0.50216115,-0.44997215,-0.5446691,0.35940802,0.73977345,-0.610638,0.16035382,-0.16382147,0.98885715,0.35310698,0.79926324,-0.31266966,0.1499051,-0.24802618,0.9994428,0.80415803,-0.34826514,-0.47606188,-0.035313334,-0.6431768,-0.5975828,-0.97768396,-0.4667659,-0.34058958,0.39781365,0.6586307,-0.20830986],
    [2,1,"CCCCNC(=O)OCC#CI",0.6646457,0.23342355,0.6395576,0.106440224,0.040658116,-0.3306483,-0.6763264,-0.49788597,0.004000091,0.37792125,-0.35359526,-0.23686498,0.4118554,0.22775994,-0.13912767,0.09440247,0.37336594,-0.10790128,0.48402303,0.7968592,0.61310405,-0.74200255,-0.25272787,0.34563938,-0.3825274,0.12292651,-0.08346178,-0.20320193,0.6307515,-0.14137025,0.45057485,0.21582094,0.78632194,-0.37639686,0.3804535,-0.16805267,0.1251788,0.48001876,-0.19837973,-0.89429235,-0.89850444,-0.4995096,-0.17821877,-0.27941796,-0.12209606,-0.99479455,0.18910232,-0.23633735,0.97248363,-0.3832701,0.258229,0.13996065,-0.10854303,0.18399817,-0.6908407,0.1246773,0.8399213,0.96877915,-0.17282023,0.64774907,-0.018362496,-0.33265606,0.4843148,0.17218727,-0.12904479,0.5142808,-0.4383087,0.32435963,0.4782534,-0.106478766,-0.53354126,-0.9952653,-0.25922385,0.7506535,0.46010002,0.2315418,-0.16663763,0.21836828,-0.27646652,-0.99991125,-0.21956639,0.41687143,-0.4453204,-0.08105792,0.37902945,0.6000012,0.6728034,0.54095787,0.2995709,-0.7890498,0.27421942,-0.2462183,0.12152154,0.54404545,0.99447215,-0.3535183,-0.4240647,0.35402066,0.36029875,0.10504279,0.007286191,0.40175885,-0.349927,0.02547492,0.9111784,-0.53232086,0.17118633,-0.44265893,-0.91659397,0.22468285,0.070833206,-0.4966171,0.48711157,0.76867104,-0.23596177,-0.12719068,-0.4489169,0.13661258,0.99813694,0.4765668,-0.68655103,0.10384202,0.8215555,0.23104973,-0.15117653,0.61776185,0.22361302,-0.4826818,0.7087162,0.9987932,0.7041355,0.4564842,0.12124377,0.18151593,0.40235913,-0.98831385,-0.2998457,0.001093454,-0.10694965,0.51687694,0.99132925,0.8344395,0.9641551,0.3916913,0.495824,0.6572877,0.037428867,-0.4248079,0.989499,0.35229844,-0.27506226,0.69337744,0.52882576,0.5929704,-0.2671119,0.055623513,-0.4007983,0.99899006,-0.23355807,0.7081981,-0.9834284,-0.74631584,0.020185392,0.21165456,-0.061876476,-0.45088255,-0.48457336,-0.39235774,0.2792447,0.48982474,0.35998422,0.46090677,0.59162825,0.12169909,0.45410934,-0.8997844,-0.5103563,-0.08619495,-0.44775885,0.22434117,0.59765255,-0.70248795,0.46322292,-0.06485199,-0.89189947,0.20465495,0.5827534,0.1389149,0.31659758,0.051220857,-0.47249854,-0.355887,-0.14277397,0.19185178,0.6667828,-0.60836524,-0.037270658,-0.69715255,0.30153173,0.15966855,-0.18113026,-0.38461286,0.6054889,0.043486558,-0.37209064,0.15222453,-0.122790836,-0.44794923,0.00446302,-0.98212945,-0.44252262,-0.21914911,0.19915871,-0.6782833,-0.39976406,0.29376513,-0.65724254,0.34141153,0.33152434,-0.21923238,0.5362052,0.020394769,0.047528457,0.4199009,-0.93800396,0.28074878,0.4412267,-0.51073956,-0.23372515,-0.50732243,-0.45629802,0.036480393,0.1433483,-0.3121016,0.49744973,0.421654,-0.37406957,-0.4226648,0.47456685,0.2506783,0.9050593,0.31929,-0.0778561,-0.39289084,-0.6570862,-0.21238862,0.65658164,0.0728142,-0.5472506,0.2933417,0.841292,-0.9998274,0.007302482,-0.025263619,-0.13805416,0.24508274,0.636785,-0.13219167,-0.36608753,-0.11245469,-0.35435396,0.5668855,-0.34282622,0.021057492,0.015268366,-0.26586607,-0.19022094,0.4487545,0.078728996,-0.37094378,0.40380093,0.9897698,0.29560655,-0.6139008,0.06550843,-0.3585833,0.10926648,0.40212673,0.07907528,0.89678085,-0.53917295,0.99917907,-0.4953115,0.32578444,-0.49310237,0.031180628,-0.34219864,-0.012755502,-0.72494626,0.012283862,0.29955676,0.9993771,-0.52490985,0.49137735,0.16469482,0.29869422,-0.9907397,-0.87201184,0.47088924,0.8024191,0.3673291,0.38481402,0.7033275,-0.10316668,-0.18020922,-0.2367924,0.995059,0.17306496,-0.035057556,-0.15920012,0.57338333,0.10995094,0.17020625,-0.18035352,0.64600235,-0.06810507,0.37378785,0.29931733,-0.957551,-0.7793882,-0.012355935,0.65852493,-0.42126188,-0.5299637,0.23214108,-0.47173166,-0.31833822,-0.897283,0.04558327,0.3421751,-0.5958387,0.8696756,-0.1937211,0.4143992,-0.53779554,-0.4484761,-0.20010562,-0.033676766,-0.31989366,-0.74995834,-0.18186271,0.024601439,-0.6051595,0.8055325,0.06246121,-0.4009869,-0.38362798,0.16886836,0.6371316,0.96289384,-0.9948966,0.43677342,0.032089643,-0.00799042,0.14790776,-0.27862132,0.053277858,0.99955183,0.33782303,0.06865738,-0.71666914,0.034457464,0.72000015,-0.019440673,-0.22010674,-0.15921284,-0.10228764,-0.11997437,0.49738556,0.61618227,0.0773925,-0.2823034,-0.52777827,0.87963754,-0.17884113,1,-0.5788471,0.27264944,-0.13660254,-0.012997992,-0.84092206,-0.04666793,0.021521062,0.6922415,0.716656,0.051476452,-0.374833,0.5723667,0.3518596,0.017784594,-0.09738296,0.43582177,-0.4083363,-0.27822158,-0.21981038,-0.8545612,0.43214616,0.45692366,-0.5024573,-0.08191436,-0.71323705,0.56498605,-0.41557157,0.44750428,-0.048291173,-0.41947815,0.14723057,-0.45970953,0.4245199,-0.7752583,0.22817174,0.110711865,0.24103458,0.34603563,0.16144395,-0.26306388,0.99994594,-0.42562273,-0.8676808,0.09398169,0.9997041,-0.14948785,-0.1994491,-0.99924123,-0.39427614,-0.3579341,-0.23124321,0.12385797,-0.11484114,0.56405663,0.34593606,0.20596647,0.10425878,0.4261845,0.031382523,0.43539423,0.71480966,0.7784848,-0.9998525,-0.99999976,-0.9920844,0.10523151,0.44066584,-0.20327511,-0.062502876,0.31951717,0.30028698,-0.37594002,0.121651076,0.3566511,-0.28987283,0.015419982,0.14154178,-0.05629996,0.23945063,-0.34608343,-0.18600065,-0.9860171,-0.9996667,-0.22131895,-0.38306466,0.15853564,0.443763,-0.3460216,-0.9580961,-0.3299687,0.29446125,0.6673178,0.7248023,-0.06951908,0.5908666,-0.8604118,0.10272242,0.46235487,0.5798127,0.124259874,0.048319854,-0.1821032,-0.18277851,-0.5990262,-0.75611365,0.23233216,-0.8634689,0.45022917,0.06336826,-0.3117386,0.30983204,-0.14561224,0.22295058,-0.04950972,-0.21615137,0.6605465,0.08111907,-0.85657793,-0.68061286,-0.57919,-0.03664666,0.64636874,-0.1273651,0.999991,-0.6012536,-0.5905574,0.12129085,-0.3496771,0.25965023,0.2656462,-0.30870497,0.20629434,-0.36052462,-0.013902825,0.28317696,0.5504246],
    [3,1,"CC(C)c1nnc2ccc(-c3ocnc3-c3cc(F)ccc3F)cn12",-0.6893194,0.048052173,0.52545017,-0.6813563,0.5417465,0.48042396,0.07914706,0.25584963,-0.27824235,-0.13184355,-0.37678835,-0.11375596,0.7136525,-0.2426831,0.48803818,-0.29246002,0.24804896,-0.20428967,0.24527453,-0.41347396,0.005837486,0.019173387,0.3017961,0.46089026,0.7115758,0.47079962,0.7685857,0.1956887,0.60231745,-0.41876292,-0.46067023,0.023551814,-0.018205447,-0.08339661,0.64455986,0.705367,-0.10912388,0.005989743,0.99926925,-0.7920301,-0.15229395,-0.13419876,0.15197003,0.11892814,0.31948337,0.16917054,-0.4944788,-0.6939567,0.0814067,-0.43058735,0.69914854,0.6615328,0.64250046,0.55086136,-0.17238058,-0.5392472,-0.8512808,-0.5341157,-0.5287242,0.28692642,0.40296075,0.44384447,0.57457244,0.56089145,-0.3653716,-0.02390901,0.014737771,-0.60092634,-0.39357364,-0.20710611,-0.92193323,-0.77122545,0.3600284,-0.9586331,0.6133705,0.32581836,-0.3663913,-0.3635038,0.34544235,-0.99927217,0.5940391,0.28357622,-0.9783551,-0.3225376,-0.45070705,-0.92570215,0.004571263,-0.39830008,-0.03220013,0.6119242,-0.31976375,-0.003968749,-0.3083211,0.27017218,0.9930295,-0.3936145,0.8467993,0.14227231,-0.26297864,0.12804167,-0.00999071,-0.043956332,0.42680117,0.94252664,-0.99729633,-0.96912605,0.2967956,-0.32098392,0.9761484,-0.34698534,-0.17329639,-0.13215634,0.06582614,-0.029126767,0.44011867,0.14122082,0.34731868,0.1689674,0.96877825,-0.043269735,-0.4527928,-0.30506596,-0.2151576,-0.2835607,-0.15091583,-0.5807621,-0.53789264,-0.3712492,0.29643622,0.999678,9.2e-05,-0.76442885,0.12542081,0.12717989,-0.12631106,-0.9802691,-0.3100327,-0.5098129,0.18233453,-0.6182778,-0.9999968,0.40401453,0.7585821,-0.004619733,-0.3318237,0.34122238,0.30283433,-0.77641994,-0.97536653,-0.25872594,0.6375613,-0.8386171,-0.83476454,0.54094625,-0.026313858,-0.5819151,-0.41771063,-0.3918842,0.20541115,-0.8619078,-0.6920545,-0.06148395,-0.34429467,-0.36918426,0.08297361,-0.042217433,0.3308806,0.41517845,0.02494991,0.48387146,-0.074116886,-0.30639932,-0.21947953,0.14567485,0.33074793,0.43378723,-0.63818824,0.23245992,-0.6809225,-0.43598762,0.21914586,-0.57661617,0.12767993,0.21960413,0.33202976,-0.15436134,0.4481613,0.058215726,-0.20570548,0.122561075,0.6161734,-0.21533677,-0.28835863,0.6800395,0.3385701,0.080134064,0.22117472,-0.6125357,0.5724418,0.25018984,0.076987304,0.013677136,0.22808743,0.32086283,0.71175617,-0.095294595,0.3630784,-0.48604536,-0.19266157,-0.9998536,0.34457907,0.23320958,-0.19424553,0.40666574,-0.5449007,-0.04205989,-0.41942465,0.4580111,-0.27065027,-0.7964545,0.20906985,0.35296604,0.74614,-0.16761449,-0.9729461,0.08082733,0.17564666,-0.03173706,-0.45389608,-0.23660354,-0.37467661,-0.81957495,-0.038364083,0.34929845,0.5147997,0.57884675,-0.020741815,-0.6657754,0.37662256,0.08269114,0.89974415,0.5432829,0.39537263,-0.3061239,0.6925657,0.6499901,-0.3402663,0.22623631,-0.25896108,-0.17624328,0.079264924,-0.016658567,-0.40070638,0.50673914,-0.13778761,0.1925158,-0.6166396,-0.021738533,0.30029553,-0.09746029,-0.020620974,-0.16541612,0.17817983,-0.9042941,0.13048115,-0.28450304,-0.21064621,0.45259467,0.9676223,0.51405084,0.5984899,0.99900895,-0.35154757,-0.010038373,-0.18667695,-0.35694873,-0.53173167,-0.23952284,0.4229822,-0.3529131,0.11503181,0.9944485,-0.20315465,0.26118946,0.4974924,0.52287066,-0.4199772,0.89263093,0.9641074,-0.034318663,0.26026478,0.7979728,0.33372176,0.06392061,-0.086490706,0.38380998,0.99999976,-0.9869198,-0.20244078,-0.03948069,0.8824712,-0.049996167,-0.67094284,-0.12892872,0.9727366,0.6081158,-0.98394084,-0.41423672,0.12247575,0.43908328,0.16480827,0.08499451,-0.30302256,-0.34149504,0.69497234,0.52779317,0.3711523,-0.7608735,-0.999951,-0.39999208,0.26132968,-0.35323805,-0.594078,-0.56360006,0.4538347,-0.28260335,0.4407124,-0.66149,-0.2651046,-0.11814299,-0.631349,0.30928093,0.7939673,-0.15467966,-0.40393013,0.7433044,0.6197905,-0.54925126,0.038655058,0.37846994,-0.46590218,0.28807774,0.25361782,-0.053318482,-0.10900421,-0.3744308,0.093646705,0.16321215,0.41561183,-0.78616834,-0.87357205,0.034299877,0.35228834,-0.07395975,0.44173324,-0.7765467,0.58887345,0.9981466,0.6811602,-0.5251614,-0.06984105,-0.43908212,0.29909137,0.7331848,-0.5300266,0.019260311,-0.1263249,0.30152807,0.55955315,-0.4313862,-0.009490166,0.7530741,0.3709776,-0.7774345,-0.21648777,-1,0.36831254,0.23981163,-0.14517823,0.53197414,-0.24521959,-0.13183537,-0.35363,0.033434764,-0.13353033,0.21225853,-0.06726417,-0.37248942,-0.19337091,0.7294162,0.10933193,-0.6162461,-0.5860463,-0.41217002,0.05378365,0.2095625,0.26798743,-0.3959694,0.49322638,-0.29601908,0.7874941,0.3515981,-0.35980186,0.46590677,0.57697517,-0.4916765,-0.8490404,0.020491786,-0.1641748,0.070568375,0.72713315,0.4211608,0.4678954,0.38367668,-0.18655165,0.11203277,0.99999964,0.7245021,-0.9729366,-0.5244875,0.99512196,-0.57928216,0.31985244,-0.99993515,-0.1371925,-0.6152153,0.6578205,0.1546813,-0.5547828,-0.026744138,0.523515,-0.2039544,-0.29166484,0.6849859,0.43711877,0.4296871,-0.4025698,-0.61064416,-0.9999213,1,0.08132261,-0.094034754,-0.41271636,-0.24956276,0.58758324,-0.2662612,-0.6180392,-0.5439451,-0.4524177,0.45601833,-0.19952306,-0.60633296,-0.31882182,-0.7737297,-0.5666387,-0.42362946,-0.04824996,0.7984688,-0.99964267,0.13099334,0.016049512,-0.2970431,0.14349812,0.34306258,-0.79879314,0.4004648,-0.24998178,-0.77731717,0.20001768,0.18049686,-0.3110177,0.9839943,-0.41371572,0.7845303,-0.241946,-0.13664289,0.6629049,-0.053750962,0.8152111,0.16884916,-0.09909077,0.0454415,-0.21125539,-0.026306827,0.13267612,0.2845909,-0.33927047,-0.27549785,0.52692884,0.6086586,0.22952005,0.15442687,0.10595483,0.99796,0.46174258,-0.34716827,-0.6396136,0.6914153,0.011344199,0.99916726,-0.21532474,0.90675676,0.48407415,-0.47806904,-0.21857448,-0.76085985,-0.9978551,0.32648578,-0.11779812,-0.35714048,-0.371847,0.15618071],
    [4,1,"Cc1cc(CCN2CCN(c3nsc4ccccc34)CC2)cc2c1NC(=O)CC2(C)C",-0.56333286,0.32617164,0.56049883,0.36776748,-0.28647745,0.2054098,0.63099885,0.15507592,0.55594623,0.25212052,-0.5810149,0.6106313,0.5756517,0.4934569,-0.67012167,-0.05255777,-0.2657031,-0.20287594,0.2603754,-0.62365115,0.39879555,-0.2663211,-0.64230305,-0.50421256,0.64508265,-0.22633988,-0.024283664,0.2457947,0.16956589,0.061932515,0.5894805,-0.016831983,-0.15758643,0.28126335,-0.79717076,0.258148,0.8968434,0.29478666,0.9997227,-0.65640736,-0.8020029,-0.29644004,0.48033383,-0.04843764,0.10863103,0.8673294,-0.7247691,-0.45224643,0.6924527,-0.7777195,-0.25096887,0.025207296,0.61355275,-0.78445023,0.49543417,0.002134626,0.10669312,-0.9284339,0.48548263,0.05242939,0.055723317,6.39e-05,0.016768822,0.71214056,0.3067503,0.40616664,-0.49406138,-0.29866496,-0.20354316,0.8325289,-0.99027705,-0.60078114,-0.35901716,-0.57553464,0.60535544,-0.71943176,0.197217,-0.10823919,0.5572895,-0.99931246,-0.61519134,0.66611814,-0.93244344,-0.16169901,0.27777436,-0.9756514,0.000503666,-0.11480661,0.17955026,0.5061811,-0.49630368,-0.2864539,-0.47506464,-0.6031924,0.9983279,-0.025926586,0.62134314,0.1393758,0.56347924,-0.5296225,-0.2824387,0.6535548,0.4174065,0.99324197,-0.99964803,-0.53261054,-0.20981975,0.31739447,-0.9732978,0.4826304,0.078480184,0.79282796,0.25967368,-0.47530496,-0.029210724,-0.42383727,0.058986668,-0.11879476,0.46277958,0.8052326,0.15470831,-0.28572413,0.054138932,-0.56419176,-0.08199471,0.659317,0.27042133,0.5790045,-0.7782912,0.99985397,-0.29084256,0.36980438,0.376979,-0.7361214,-0.44173762,-0.99175215,-0.11114036,0.2174125,0.4318347,0.13028955,-0.9999999,0.38478938,0.15304738,-0.3331609,0.53941613,-0.10441508,-0.78104514,0.26468965,-0.99888915,0.22082756,-0.43925875,0.79861355,0.5846615,0.46048155,0.059759915,0.4759054,-0.3600472,-0.98266524,-0.43524566,0.06756909,0.49115202,0.35143575,0.5230883,-0.12863274,0.93469197,0.6536518,0.7878963,-0.12913042,-0.128881,0.061999634,-0.053878166,-0.62619406,0.73361063,-0.046654753,0.46523458,-0.6713987,0.2874121,0.33136776,-0.75487304,0.13032474,-0.113493726,-0.33818737,0.32295355,-0.6254725,0.62723094,-0.21391802,-0.1277707,-0.5006714,-0.39329654,0.045093853,-0.031891093,0.5193588,-0.40541488,0.010775999,0.14654751,-0.5212204,-0.19966628,-0.85846716,0.12605195,-0.16154668,0.31439584,-0.3765479,0.13986403,0.43695983,-0.22446357,-0.45535463,-0.43462643,-0.86381,-0.3894658,-0.9998867,0.20420353,0.7738423,-0.41161263,0.305266,0.54597986,-0.6718285,-0.35847682,-0.6101203,-0.19428062,0.066952884,-0.3532178,-0.3151325,-0.34398898,-0.28053984,-0.98776823,-0.7645966,-0.46473196,-0.20304382,0.020975564,-0.33478814,0.23572424,0.10234953,-0.023196569,-0.2858408,-0.1589719,0.13650192,0.14600553,0.3844665,0.29299828,-0.16465619,0.7589348,0.1915737,0.4484093,0.16753565,-0.24288332,-0.436129,0.33181328,-0.15179892,0.20822044,-0.023177199,-0.30243826,0.7183273,-0.3558729,-0.15319806,0.29334238,0.118330404,0.7751145,-0.50912386,0.28743625,-0.31586367,-0.5971551,0.13389687,-0.6499706,0.6261599,-0.41885048,0.09158684,0.20182493,-0.1903266,0.84155226,-0.11762931,0.5018932,0.9993637,-0.4547656,0.23477982,-0.7609462,-0.3131952,-0.097461134,0.0709645,-0.6354106,0.24893658,-0.3166247,0.9263235,-0.09742977,0.061132446,-0.01671434,-0.1814263,0.2543214,0.7812951,-0.640356,0.65972084,-0.13450347,-0.6799794,0.2136871,-0.76495063,-0.02669382,0.43650058,1,-0.9882056,0.54044765,0.4686568,0.15005681,-0.3365255,0.060435414,-0.74516195,0.27447635,-0.79703957,-0.999411,-0.18757649,0.847615,-0.4977058,0.29720646,-0.73656744,0.3764142,-0.5571045,0.77733594,-0.004372529,0.72480154,-0.029107295,-0.97751534,0.3399536,0.2931475,-0.39594412,-0.49948138,-0.62335587,0.44278687,0.24364606,0.028045665,-0.8946135,-0.32612193,-0.057055976,0.29753694,0.12319375,0.7364395,0.07293581,-0.06942456,0.79654896,-0.53872734,0.3064167,-0.20672214,-0.17873128,0.14408852,-0.40364027,0.42271173,-0.67881227,-0.15344824,0.8271541,-0.03733817,0.32000816,0.6510158,-0.99111235,-0.1772088,0.36057073,-0.59422916,0.44414347,0.71058685,-0.7571918,0.1704978,0.9995056,-0.870422,-0.77804697,-0.35902786,0.049598195,0.52667034,0.17866313,-0.8293109,0.55739963,0.66864246,0.19962263,0.1227299,-0.15250377,-0.5389347,-0.123402685,-0.43863377,-0.8452089,0.18151008,-1,0.001612178,-0.3893754,0.3138495,-0.5440652,0.7667313,-0.4936015,0.6465718,0.14514561,-0.4109279,0.28815097,-0.46913606,0.19933306,-0.14241947,-0.9355814,-0.07618814,-0.39685348,-0.41065586,-0.21635608,-0.85581946,0.78413975,-0.49516657,-0.08106421,-0.8453519,-0.74686325,0.86410475,-0.2403736,-0.44097942,-0.42683622,-0.73355633,-0.27819553,-0.4842571,-0.3277002,-0.14402522,0.59496206,0.6004195,-0.33521762,0.023966484,-0.69707227,0.38017035,-0.66441625,0.9999348,0.45575264,-0.9798769,0.68564266,0.9968633,-0.035756152,0.038432706,-0.99910396,0.39962146,-0.9758557,-0.44603094,0.027978973,0.3037221,-0.6686642,-0.018075164,-0.70641965,-0.18492249,0.060881432,0.82039624,-0.6262338,0.4186472,-0.27236646,-0.9995883,1,0.9235558,0.43426034,0.104716584,-0.5795639,-0.48346502,-0.39380857,0.16092215,0.8899217,0.027330553,-0.15240104,-0.036509056,-0.6782483,0.057597823,-0.19279341,0.13064618,0.16757771,0.06652979,0.9879312,-0.9952182,0.61454505,0.5744218,0.8044224,-0.27140442,0.53007877,-0.8707907,-0.09119065,-0.22177704,-0.35450938,-0.40448353,-0.35701323,-0.31863192,0.9760614,-0.35955468,0.91860616,-0.008891133,0.47470775,0.50381213,0.3359142,0.070719,0.2861766,-0.22903553,-0.6390844,-0.3467697,-0.25207847,0.1385939,0.869664,0.43636632,0.11175974,-0.4560718,-0.41863796,-0.031505007,0.42390215,0.4576038,0.99962974,-0.34878778,0.33456078,0.29047024,-0.515485,-0.14061299,0.99995214,0.3961841,-0.33081228,-0.55459136,0.20759813,0.6108756,0.47522673,-0.9992634,0.1220653,0.32256985,0.40417793,0.01747547,-0.31585565],
    [5,0,"CCCCC(C#N)(Cn1cncn1)c1ccc(Cl)cc1",-0.30410075,-0.05625293,0.61439735,-0.29636207,-0.18883072,-0.2353732,-0.5298455,-0.18109979,0.23518606,-0.12909418,-0.31925166,-0.35288107,0.47096175,-0.7636525,0.105865166,0.0594394,0.27695766,-0.705309,-0.36958814,-0.042172547,0.5037231,0.004398973,-0.605976,0.10621286,-0.18770534,-0.07198843,0.4093321,0.09884052,0.13908519,0.006044658,0.6179171,-0.5014735,0.6638025,0.47510237,-0.33395356,-0.23575434,0.5619146,-0.04629096,0.9905274,-0.6900473,-0.8350308,0.5726108,-0.015491203,-0.1809547,-0.38167563,-0.85661095,0.110633895,-0.14576137,0.8891903,0.30896997,0.5346538,0.37844414,-0.2160906,0.2203617,-0.8929986,0.08593082,0.040413704,0.34375513,0.4298093,-0.038015947,-0.093766935,0.29373273,-0.0826096,0.086890236,-0.07475354,0.016567085,0.25362766,0.7943038,0.022838116,-0.11871229,-0.61845016,-0.9034229,0.22823778,0.22609214,0.6628739,-0.04273282,0.6978628,-0.2715763,-0.6495799,-0.99916553,0.54313576,-0.39437932,-0.93189895,0.84508425,-0.26877746,-0.7982731,0.65570575,-0.26334515,-0.3460441,-0.37328777,-0.3127944,-0.025599135,0.05419156,-0.43379512,0.9924745,0.39063838,0.47778147,-0.4801532,0.45026898,-0.019594634,0.058648247,-0.5219861,0.007985717,0.828178,-0.9260225,-0.8210737,-0.68161947,0.14062776,0.9874105,-0.56240904,0.45464626,0.23339447,-0.6055293,0.8419453,-0.67169315,0.21214771,-0.6433426,-0.15849186,0.9965324,-0.19538574,-0.6787159,-0.23477335,-0.44010508,-0.13905498,-0.46962315,-0.20990786,0.19250429,0.10342696,0.34059644,0.99973714,0.58981913,0.17557824,0.18716273,0.5940464,-0.1405755,-0.9932789,-0.36050135,-0.16316313,-0.079605184,-0.6860315,-0.99991,-0.42583346,0.89745355,0.2808885,0.7232423,0.43943995,0.18636273,-0.009629017,-0.082232594,0.14509878,0.20732781,-0.90173656,0.4638279,0.44742507,-0.31874093,0.4736817,0.7765176,0.8828241,-0.3027218,-0.8940484,-0.9389537,-0.38491753,-0.73968077,-0.86297184,0.00020159,0.00357617,-0.090077564,-0.41300133,0.16885835,-0.13859218,0.4546659,0.74908406,-0.555671,-0.116626106,0.20963034,-0.47684085,-0.45261577,0.120465115,-0.42855647,0.072354496,0.18064287,-0.89850104,0.039593913,0.23458827,0.05993244,0.38268366,-0.035637945,0.60696477,-0.7859146,-0.41931468,-0.5440443,-0.72565514,-0.049923465,0.3537715,-0.21120994,0.3916224,0.14628862,-0.3185153,0.08520826,0.6838719,-0.2488746,-0.13227011,0.28808582,-0.16073339,-0.12548502,0.15846299,-0.2960817,-0.09947298,-0.51857847,-0.9994033,0.036721732,0.056827653,0.31161842,-0.09837304,0.09015054,0.49173504,-0.18351407,0.27675447,0.06835639,0.05184286,0.50719756,-0.27417973,0.43742868,0.052544657,-0.9540451,0.5001807,-0.057650235,0.19243056,-0.10223621,-0.14007646,0.30952817,-0.5237525,0.6073769,0.32563755,0.6141373,-0.53386855,0.5351269,-0.89199734,-0.07501756,-0.62794936,0.8935949,-0.12273909,0.12630634,-0.03094617,0.12151251,-0.58144015,-0.38288963,-0.09516759,-0.18138194,0.7580732,-0.20794578,-0.9598751,0.39440528,-0.18619163,-0.030946769,-0.7623272,0.6010119,0.27732578,0.11939366,-0.181168,-0.5202787,-0.23538367,-0.32686108,0.006403895,0.5486703,0.058405433,0.5151175,0.030656159,0.781842,-0.53722894,-0.093475334,0.9927224,-0.8305583,0.30248463,-0.58442134,-0.114024125,0.67079735,-0.8831639,0.25854093,0.17830063,0.73304963,0.998612,-0.282565,0.32692873,0.1206627,0.8434821,0.35785013,0.82084554,0.856558,-0.106601976,0.23150305,0.98890114,0.069486074,0.7898654,-0.008435327,-0.89364463,0.9999849,-0.9809348,-0.29514304,0.5991874,0.00766594,0.35544646,-0.43441156,0.61630005,0.8753385,-0.15250474,-0.46498024,0.014603362,0.46057937,0.45428056,-0.22904094,0.038016107,0.39773738,0.10225926,0.18497173,-0.070509136,0.022877304,0.50031704,-0.9999343,-0.67080355,-0.560781,0.24083346,-0.25644672,-0.65091294,-0.02420916,-0.48822662,0.62795675,-0.64021397,0.49954948,0.08550645,-0.42143348,-0.5113012,-0.36283302,0.5500504,-0.17446238,0.4109657,0.098158464,0.89555615,0.22244343,0.008368498,-0.31665862,-0.65612066,0.8125911,0.5594988,0.56435424,-0.2112458,-0.9305774,0.6515098,-0.62788993,-0.114054665,-0.97719145,-0.20491825,0.6857778,0.476448,-0.1435427,0.7510092,0.65351796,0.9997959,-0.58796525,0.35910955,-0.2596976,-0.17886733,0.010090324,0.27029264,-0.5630264,0.10920729,0.24118665,-0.33832395,0.19837785,-0.09319069,0.124144755,-0.45802906,0.018251548,-0.28328702,0.59654504,0.99324435,0.19571179,0.20444568,0.48998475,0.8645832,0.14250942,0.22796503,-0.049315926,-0.19772817,0.31189388,0.5379691,-0.42624667,0.62216204,-0.62229246,0.4695284,0.5683679,-0.061232395,0.14313225,0.49148077,-0.007408974,-0.76024956,-0.5446844,-0.66211665,0.46753198,-0.12840152,-0.025706599,0.5608082,0.34187362,0.49868295,0.038316306,-0.060601253,-0.45929837,0.79679257,0.081380956,0.25040463,0.479954,0.42438143,0.13729313,-0.2552952,0.46519098,-0.072202355,0.99999976,-0.44024882,-0.9447979,-0.4580499,0.9983227,-0.6207813,0.3484967,-0.9999289,0.102513194,-0.072473854,0.36018488,-0.13838544,0.30041143,0.46682423,0.33302996,-0.17515035,-0.1667752,-0.19911909,-0.25127104,-0.7928784,-0.41713688,-0.4214964,-0.9999429,0.9963352,-0.86158663,-0.4218877,0.591574,-0.2440123,0.82476413,-0.10102116,-0.44863892,-0.53353524,-0.26150316,0.071453914,-0.45746222,-0.20258524,-0.60559344,-0.2749668,-0.004070408,-0.34149125,-0.43673953,-0.13586345,-0.99985427,0.74270856,-0.66244733,-0.5406857,0.087924786,0.42040184,-0.77493775,-0.54373497,0.004835143,-0.043623045,-0.17979245,0.2950251,0.59966046,0.9489824,-0.022842236,-0.061900996,0.030784205,-0.025373707,-0.18279341,-0.03526482,-0.592987,-0.7426324,-0.33624613,-0.01872853,-0.6177674,0.04419999,0.46322727,-0.26642793,-0.10985382,-0.29646346,-0.0278303,0.38613144,-0.36733988,0.61905146,0.22567712,0.9614849,-0.2621932,-0.19449344,-0.12029545,0.23009406,0.2773378,0.9996059,0.45884764,0.070113935,-0.07825136,0.13313481,0.48397523,0.099217944,-0.9870819,-0.5729657,0.20687264,0.31072772,-0.08079262,0.46896917],
    [6,1,"C#CCN1C(=O)COc2cc(F)c(-n3c(O)c4c(c3O)CCC=C4)cc21",-0.50083905,0.5237791,0.23836952,-0.09190412,0.14419204,-0.032598328,-0.17746337,-0.1336214,-0.58761793,0.691287,0.08634744,-0.8449302,0.9440673,0.37353513,0.10079582,0.47653866,0.5496234,-0.42823732,0.61330384,0.24108644,-0.08856667,-0.4605314,0.8830154,0.25979915,-0.05616356,0.8931337,0.31577897,-0.17801443,0.53195333,-0.39594823,-0.20263101,0.24198171,0.15509117,0.07884669,-0.32778817,-0.3472342,0.13475548,0.27513257,0.9997038,-0.35355204,0.51758385,0.2474326,0.33773407,-0.1983326,0.4319793,0.41911158,-0.37095797,0.14124012,-0.1438061,0.1321058,0.9213292,0.41311678,-0.14661098,-0.2644979,-0.106664434,0.47941205,-0.08354299,-0.89571595,0.61131227,-0.30856863,0.307695,-0.54785,-0.27658597,0.15374401,-0.28077984,0.25785324,-0.19846262,0.2226694,-0.7509769,-0.23905759,-0.9767724,-0.97292024,-0.06602693,-0.7398476,-0.05096907,0.021862876,0.2814966,0.34678617,-0.29076868,-0.9981448,-0.7698448,0.52119434,-0.95833063,-0.25622302,-0.37293664,-0.72152746,0.17150028,0.5348659,0.37783107,-0.12707768,0.08502462,-0.006847164,-0.6157316,0.16406871,0.9990983,0.2963328,-0.24584833,-0.57982945,-0.4095214,-0.23522624,0.16114582,0.17979777,0.106293485,0.72052795,-0.99945104,-0.25376874,-0.2574825,0.43908736,-0.9997185,0.31837928,-0.42849132,0.3365454,0.61762965,0.21680583,0.2547453,0.6027571,0.289081,-0.07318674,0.9501823,-0.6262234,0.27495867,-0.20259425,0.48228428,-0.85391784,-0.36412734,0.14226264,-0.49325857,-0.737501,0.48753324,0.9969481,-0.2543556,0.12364007,-0.31935725,-0.0442976,0.29633993,-0.8328102,0.38220772,-0.37469462,0.041661244,-0.9253962,-0.99999875,0.7816089,0.31079796,0.8809185,0.45579198,-0.44689775,-0.122143865,-0.43041307,-0.995548,-0.52433294,-0.21888588,-0.32218015,0.17525417,0.12810756,-0.13375184,-0.63059354,0.36972955,-0.8369799,-0.56220526,-0.16988337,-0.3746596,-0.40836293,-0.56596285,0.42366233,0.83556855,-0.5412526,0.5403416,-0.3874382,0.005581095,0.8184623,-0.7273085,-0.13001847,-0.10483636,0.6507977,0.14210217,0.03237071,0.6975071,0.57562184,0.13487095,0.3736232,0.5381756,-0.85120887,0.32677963,0.13938476,0.8541078,-0.026119132,-0.24427316,-0.004499573,-0.5532346,0.38131762,0.6680228,0.051962,0.26643765,-0.71252656,0.4872771,-0.2113426,0.6160025,-0.09175389,0.4628866,-0.29257834,-0.7754037,0.17418514,0.7623938,0.11242095,0.31313014,0.22693056,0.04063896,0.53939307,-0.098617,-0.9998549,-0.083373226,-0.062307686,0.5064614,0.48280346,-0.012504953,0.23936814,0.5872722,-0.24055223,0.1275494,0.5628623,-0.189654,-0.004519858,-0.10464278,-0.25511792,0.9999732,-0.014245287,0.2287022,0.60125804,-0.19122607,0.35349935,-0.75431424,-0.31172812,0.1753198,0.14967702,0.18509553,0.7579103,-0.22425634,-0.15607457,0.2767345,0.13132395,0.86544687,0.2518589,0.18123223,-0.6556883,-0.2420236,-0.38135332,0.84911644,-0.40843707,0.13652603,-0.5380143,0.097912855,0.050964724,0.1487706,0.20843616,-0.39911312,-0.20864439,-0.41566917,-0.42275405,-0.57688874,0.8463795,-0.058854237,-0.614619,0.05381684,-0.63857496,0.12614265,-0.50746715,-0.19599703,0.46084714,-0.29898715,-0.4959962,0.7646455,0.99991554,0.581125,0.23132636,-0.64105934,-0.5574785,0.37177157,0.12453423,-0.1095482,-0.3357267,-0.16968574,0.98358566,-0.35199717,-0.36469293,0.10960576,-0.6674321,-0.19410561,0.4676846,-0.81153697,0.35245192,0.22299263,0.46739492,-0.7766648,0.7058324,-0.75289196,0.3422979,0.9999996,-0.90601325,-0.010969079,-0.36871192,0.15500492,-0.24082085,0.437396,0.11513319,0.1317176,-0.6280507,-0.9935228,-0.40813273,-0.43484786,-0.57620615,0.5024196,0.6073193,0.5324314,-0.21265446,0.18241794,-0.1576693,0.1139321,-0.33278733,0.9383358,0.45337,0.30864272,0.2866965,0.17205782,-0.07792447,0.23565146,0.8226547,-0.85172164,-0.14817764,-0.09732419,-0.60655755,0.10519107,0.12047277,0.22285478,0.6521362,-0.02367559,-0.41125646,0.3823274,-0.66152287,0.67406267,-0.4141057,0.48115394,0.27232808,0.27644408,-0.82071686,0.15964477,-0.82180816,0.73696357,0.102834314,0.024724405,-0.90307736,-0.5846561,-0.44294715,0.20676124,-0.2335901,0.19810776,0.205047,-0.2075538,0.9995972,-0.07874329,0.6199858,-0.012400956,0.6646391,-0.1526737,0.45173502,-0.7412017,-0.8466486,-0.46914792,0.60944444,0.3646127,-0.020101165,0.26036718,-0.6719805,0.6798387,-0.86758417,-0.004560628,-0.99999917,0.82061964,0.11433336,-0.45520505,-0.2759566,-0.5021422,-0.2524631,-0.45969966,-0.06386087,0.4723297,-0.4452464,0.14532873,-0.17078857,0.6151609,0.049586937,0.15823103,-0.027392397,-0.28518116,-0.31443006,-0.21572521,-0.104009435,0.17496301,0.08167098,0.6751555,-0.06583004,0.9206662,0.1081369,-0.8385325,0.44747666,0.06587167,0.3923057,-0.24372868,-0.76948714,0.514437,-0.13900584,-0.44138727,-0.056237202,-0.13143198,-0.6910063,-0.34095,0.64098924,0.91613144,-0.15361029,-0.85988,0.17380172,0.99974555,-0.66825897,0.09817815,-0.9918785,-0.22614765,-0.5846387,0.60205823,-0.8359279,-0.061788376,0.076982364,0.2564322,-0.4201115,0.35681048,0.2484643,0.8135137,-0.05627189,-0.5224746,0.34314126,-0.99995404,1,0.2771085,-0.51267165,0.026070325,-0.23822588,-0.3531414,-0.06702955,-0.3149755,-0.78497916,-0.019291531,-0.2855768,-0.7167684,0.5948862,0.24478655,-0.32422277,0.4669608,0.25027773,-0.8826313,0.9041098,-0.99934965,0.4555622,0.31672055,0.24765715,0.2265959,0.40210283,-0.28262305,0.5319807,-0.29942232,-0.5337165,0.31597972,-0.6459959,0.0567824,0.94488597,-0.40205252,0.4210777,-0.08708034,0.48254123,-0.41726443,-0.5372943,-0.66108835,-0.42717618,-0.20668101,-0.16170551,-0.98451406,0.3443269,-0.69150954,-0.75650585,0.70041615,-0.110550076,0.8838291,-0.4326944,-0.101462275,0.63799894,-0.2415131,0.99855757,-0.6407945,-0.58606815,-0.64058363,0.15548794,-0.26648396,0.9999515,0.065262936,-0.68262774,-0.6725379,0.22923642,0.5319164,0.22845024,-0.9990933,0.18867263,0.34701732,0.85380185,0.07046629,0.19603775],
    [7,1,"CCCCCCCCc1ccc(O)cc1",-0.68334717,0.10565174,0.13234812,0.44366437,0.3751065,0.000291578,-0.48261443,0.047051933,0.26890597,-0.21703388,-0.8169378,-0.29356197,-0.026197726,-0.884938,0.5496591,0.63150173,0.64983886,-0.3808202,0.3203229,-0.25448567,0.17489482,-0.8542323,0.22861698,0.49684832,-0.10063854,0.23384343,0.18181023,-0.36805645,0.6525944,-0.3632382,-0.09207362,0.5908947,0.60054815,-0.11102533,-0.010436776,-0.38090643,0.16240977,0.71951675,0.53943133,-0.94604576,-0.9884433,0.09564423,-0.075808465,-0.13420603,0.17215766,-0.988361,0.145613,-0.32639635,0.957718,-0.13191716,0.7354076,0.07054636,0.008195441,-0.001045941,-0.92006075,0.07497677,0.7739542,0.9691868,0.48016825,-0.26695222,-0.2988334,-0.288578,0.003664376,0.028354587,0.12775977,0.16435371,-0.47313464,0.43198085,0.48043656,-0.09733926,0.7810174,-0.53691,-0.13133383,0.22018278,0.88937473,0.48588794,0.05365009,0.12732641,-0.13669886,-0.9983702,-0.75447357,0.07498768,-0.8877753,-0.21901134,0.18050662,-0.85879743,-0.44390434,0.009370592,-0.071609266,-0.7799705,-0.45397827,-0.05234893,0.2349363,-0.16297422,0.30855423,-0.2981409,0.8208612,0.15525927,0.27301648,-0.25383204,0.04670035,0.018535065,0.32176617,0.8929015,0.7098382,0.62959886,0.39475626,0.36322325,-0.94383496,0.34652507,0.10177786,-0.112170726,0.630622,0.11903693,-0.23779702,0.3907201,0.10639877,0.30932415,0.99688476,0.57921255,0.13665496,0.10080963,-0.024764303,0.21236649,-0.6217724,0.4551143,-0.085515894,0.33624795,-0.013050611,0.9999792,0.117429525,0.41743875,-0.35442242,-0.003351399,-0.42808115,-0.46427056,-0.004453816,0.73393923,-0.43758404,-0.10733119,-0.99565995,0.04788171,0.9949904,0.2569424,-0.39032388,-0.02597429,0.51099545,-0.36659133,0.97291523,0.42251006,-0.3891491,-0.8299625,0.8088278,0.5702641,-0.2881074,0.2561464,0.3147633,0.995653,-0.08383728,-0.47541007,-0.98310626,-0.33908165,0.3221367,0.42109725,0.35382885,-0.16971532,-0.14818203,-0.34488636,-0.41842705,-0.2963317,0.047443755,-0.08137911,0.2720515,-0.07022247,0.10668722,-0.9857728,-0.55741656,0.5677914,-0.61601096,-0.40560243,-0.012024659,0.68253714,0.48394302,0.7659111,-0.908515,-0.08664795,-0.02773418,0.406829,-0.4210629,0.4286799,-0.47743726,0.37629065,0.3620998,0.6144593,-0.039187357,0.054665674,0.3742602,-0.35992754,0.7454413,0.4632637,0.024695553,-0.4419844,-0.11617007,0.330829,0.32124355,-0.3317566,-0.022801748,-0.8075343,-0.25783074,-0.98931116,-0.18615729,0.2588133,0.059925046,-0.57366836,0.42455038,-0.102683075,-0.08882155,0.23947057,0.1756044,0.031871565,-0.16866189,-0.10965539,-0.4835457,-0.16433519,0.9988599,0.5573913,0.40189534,0.36728215,-0.16486181,-0.30062002,-0.21760428,-0.24617016,0.49631017,0.20596503,0.04641529,-0.11069769,-0.19311139,-0.60916746,0.43461773,0.32286996,0.90349036,-0.3047458,-0.3128364,-0.33513606,-0.26556894,0.20581114,0.33580285,0.09345333,-0.18103553,0.06529605,-0.097247295,-0.99778515,-0.14666574,0.763662,0.097504534,0.23107794,-0.32860115,-0.16630504,0.70406353,-0.37219396,-0.6349548,0.39221513,-0.6353951,-0.6522257,0.5905644,0.5318063,0.7188824,-0.43410385,-0.7042617,-0.33890182,-0.2885821,-0.26510388,-0.31511474,-0.09629727,-0.37333193,-0.4067154,0.29895735,-0.22025979,-0.19588386,0.6391026,0.058719832,0.9993737,-0.37445122,0.77502227,0.042375784,0.11630051,0.09782937,0.4077452,0.83097637,0.509879,-0.27626044,0.99871486,-0.14555342,0.099766314,-0.16026346,0.72994137,0.99651897,-0.99788165,-0.28185844,0.32989028,0.16694523,-0.49202684,-0.09941379,0.4934335,-0.22356239,-0.94221544,0.949792,0.58053607,0.3413344,0.28490654,-0.04257585,0.041493267,-0.045767933,-0.2918699,0.94172513,0.12748328,-0.086468846,-0.13931918,-0.94235015,-0.5738563,-0.09954845,0.26298228,0.31703326,-0.84471357,-0.4646955,-0.57271683,0.39651927,-0.9702668,0.48890716,0.45516986,0.31603155,-0.22348899,0.3069952,-0.47788712,-0.17165962,0.92735976,0.14399646,0.14499195,0.7296827,-0.031721067,-0.29680628,0.48010534,0.22655232,0.75975996,-0.05342756,-0.06986094,-0.5644254,-0.16499454,0.17373173,0.85941696,-0.9964041,0.2125042,-0.588046,-0.28067264,-0.11874792,0.25625455,0.48673916,0.99943537,-0.14831913,-0.11458324,-0.11080101,0.16754866,0.28995928,-0.041223533,-0.8188993,0.23052424,-0.70337474,-0.8092206,-0.4309341,-0.05442849,0.097835675,-0.17422166,-0.7962212,0.8937003,0.39770362,1,-0.35652235,0.06486987,-0.26180506,-0.13302003,-0.59768146,-0.45327505,0.8159726,-0.5395702,0.20570675,-0.49053589,0.34571663,0.2480886,-0.04293883,0.31316802,-0.29871753,0.022460166,-0.24303934,-0.38358417,-0.176442,-0.7808048,0.5176296,-0.62585557,-0.6446239,-0.39936003,-0.9546149,-0.19325441,-0.57417125,0.1871191,0.13280801,-0.4204523,-0.497936,-0.72088337,-0.2824129,0.45851415,0.51544994,-0.3698076,-0.42922536,-0.28643918,0.28846708,-0.6529456,0.9998727,0.39075062,-0.97231376,0.022148948,0.99913216,-0.6486416,-0.5034151,-0.9982365,-0.069854975,-0.31360236,-0.43415087,0.2543763,-0.10470977,0.71638685,0.37613612,-0.86224896,0.025588643,-0.27563655,-0.5569049,0.052626256,-0.057108708,-0.19749944,-0.9998803,-0.9984644,-0.9408237,0.47660294,-0.044171877,0.16965786,-0.2603661,-0.6301996,0.8206286,-0.22028871,-0.024198692,-0.12041676,-0.6471208,-0.6223895,-0.3612284,-0.16133852,0.23048128,0.077849895,0.29615197,-0.9299899,-0.9997643,-0.52630824,-0.67842203,0.27049047,0.50301605,-0.18687825,-0.9979622,-0.18053712,-0.6894883,-0.5133092,-0.4574675,0.04732331,0.38257954,0.89828056,-0.41868943,-0.48526892,0.6285325,0.6644082,0.38133764,-0.86582524,0.0856783,-0.5355462,-0.41628802,-0.35794264,-0.5625571,0.6429301,0.21486233,-0.24229148,0.03494456,-0.5670007,0.25328425,-0.43911603,-0.45252576,-0.10541921,-0.06271225,-0.087875426,0.19640467,-0.5359532,0.11643077,-0.17409404,0.35761797,0.999948,0.7980417,0.51795655,0.45091075,0.68317336,-0.17121306,0.020733012,-0.49486217,-0.077953435,0.55126107,-0.35816973,0.5649781,-0.33380163],
    [8,1,"CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3nonc3c2)cc1",-0.7046486,-0.36558014,0.4518335,0.19985999,-0.13764516,-0.37094718,-0.5315128,0.18578538,0.44496801,0.07801469,-0.18833056,0.3425504,0.12282589,0.09665147,-0.39821067,0.28720984,-0.08739945,-0.9041721,0.648364,0.5131686,0.58082217,-0.021555599,-0.7107482,-0.48817074,-0.17298898,0.56402546,0.15502068,-0.6955232,-0.34791887,0.4034027,-0.15734825,-0.18677948,0.4315148,0.15732594,0.078939795,0.15535502,0.26360607,0.60179216,0.99970305,-0.47129926,0.037670508,-0.12704207,0.517713,-0.05004523,-0.39307234,0.7746071,-0.26172748,0.06564983,-0.3612262,-0.42426237,0.8420654,0.17208737,-0.57519096,0.11725479,0.6753721,0.33572164,-0.27773908,-0.8720094,0.4786201,-0.22979894,0.19215178,-0.007868885,0.07357827,-0.35336766,-0.47741625,-0.34778443,0.286963,-0.23565811,-0.13385046,0.06620188,-0.97666365,-0.970855,-0.46150666,-0.8146093,0.22842547,-0.118843384,-0.14655463,-0.15438151,-0.7878174,-0.9994143,0.25748715,0.21496236,-0.92528147,0.18128543,0.013167782,-0.8943117,0.17166921,-0.18297257,-0.25773275,0.11845038,0.003314389,-0.15113923,0.28255984,0.67134315,0.9997936,-0.518119,0.55138427,-0.23336707,-0.3048782,0.1530268,0.41074744,-0.664455,0.31433216,0.99162996,-0.9996813,-0.9293613,-0.11572977,-0.02281977,-0.999446,0.5003184,-0.2352229,0.3320372,-0.080754206,-0.10044288,-0.4245564,-0.5377859,-0.5406887,-0.017366564,0.7282129,0.36466745,-0.046143144,-0.37716037,-0.3574931,0.2126952,-0.40383,-0.5759391,0.20607199,-0.8254424,0.17526965,0.9986121,0.04371981,0.45307013,0.09978418,-0.09141359,-0.14021125,-0.9585705,0.04363758,0.43997657,0.13195048,0.34014675,-0.99999607,-0.34776974,-0.5017071,0.345096,-0.32911658,-0.47125986,0.055832125,-0.31410465,-0.99803615,0.35834405,0.07442055,0.6571139,-0.044356015,0.59897697,0.33666465,0.6336615,-0.13329363,-0.9485358,-0.78485686,0.75274587,0.075037405,0.42836818,-0.23738213,0.16759798,0.59527254,-0.34246913,-0.092444815,0.48379108,-0.17053428,0.024804417,0.5052951,-0.088914745,0.38809028,-0.7407555,0.23847425,-0.023033045,-0.3488527,-0.41350582,-0.51982963,0.6750481,-0.28329787,-0.97230476,-0.08350847,0.3061074,0.7881902,0.54584163,0.5197845,-0.32924038,0.31637228,-0.12550293,-0.024066085,0.12700416,-0.58054584,0.45842993,0.53434986,0.016782477,0.32462558,-0.4806472,0.14918078,-0.56326026,-0.3707078,-0.68387634,0.63175344,-0.34657398,0.53110814,0.16961958,-0.26808172,-0.4871405,-0.09793742,-0.99989325,0.6851872,-0.40350172,-0.60576653,0.18450043,0.3971679,0.13182268,0.679778,-0.3061591,-0.3953584,0.02852104,0.28336316,-0.3063492,0.77475864,-0.38049877,0.92288715,0.23665848,-0.5674337,0.8103518,0.17167756,0.5299958,-0.15981397,-0.02020052,-0.14808974,-0.5457136,0.23609549,-0.20180048,-0.54568875,-0.41912904,-0.13897495,0.60102075,0.8916015,-0.5225091,0.12406895,-0.040634245,0.8425709,0.081866436,0.45074803,0.75469506,-0.11296845,0.029261466,0.24293971,0.031648044,-0.19742025,0.62387353,0.3502188,0.5117928,-0.630312,-0.14600922,0.5554881,0.26548818,0.20441578,0.3221668,-0.58760554,-0.6116126,-0.30827537,0.5638888,-0.057951845,0.43501887,0.5749768,0.11112159,-0.18508133,0.99826264,0.042892653,-0.21443208,-0.5278203,-0.0382167,-0.4171443,-0.12034295,0.15511435,0.47942173,-0.09269245,0.9627636,0.000956401,0.12664835,-0.75316775,0.6522259,-0.3200236,-0.3403542,-0.9861325,0.4602997,0.25494936,-0.2659079,0.1846496,-0.30991614,-0.34982795,0.049748667,0.99999964,-0.91338116,0.77721334,-0.6072356,-0.34573546,-0.38353494,-0.80129975,-0.5956554,0.73669165,0.47425896,-0.999208,-0.31374842,0.8601755,0.4543467,-0.44857782,0.085377716,-0.7046692,0.46159223,-0.105831556,0.5662999,0.085914895,-0.23723096,0.9409859,0.31461543,0.13540028,0.1564628,0.2933559,-0.8299665,0.002346171,0.32758576,0.581195,-0.3320806,-0.52235454,-0.27386817,-0.3017287,0.56716555,-0.425392,0.18865494,0.51331425,-0.21670061,0.38174754,0.47015223,0.15870588,0.081418835,-0.22125356,-0.28289413,-0.17437433,0.65740305,-0.54977393,-0.66148233,0.00324095,-0.6370214,-0.41702518,-0.97540677,-0.39798826,0.49187994,0.04030999,-0.012287943,-0.05614557,-0.138294,0.31338888,0.99910665,0.5507999,-0.10542175,0.49742648,0.48414892,-0.24559094,0.16612184,-0.41894153,0.34959623,-0.038267598,-0.6190375,0.6493339,-0.19708382,0.09622879,0.26883295,-0.5902662,-0.6859192,0.18962693,-0.9999997,0.031409618,-0.62141323,-0.47810516,-0.17611235,0.54297686,-0.7504412,0.014863567,0.12244954,0.23572917,-0.6599242,0.66363025,-0.30734193,-0.008130679,0.5082734,0.13883191,0.04234791,-0.050319448,0.61784464,0.10393992,0.3194766,-0.4572104,0.54692394,-0.8557205,0.28247565,0.9907952,0.72658145,-0.06516331,-0.2935134,0.2398292,-0.35160983,-0.17830305,0.48757574,-0.16082108,-0.061231676,-0.22402894,0.4998767,-0.3579622,0.72186244,0.105127685,-0.39939296,0.9435075,-0.30746293,-0.9850276,-0.2830685,0.99910223,-0.59077424,0.05778251,-0.98949224,0.50802284,-0.85810333,0.03758411,-0.31362674,-0.28760427,0.2588346,0.015222635,-0.105942644,0.08254336,0.815889,0.109786354,-0.5557398,0.000910316,-0.4321358,-0.99976844,1,0.9076155,0.6240657,-0.15024526,-0.6819643,0.6046283,0.14509521,0.069,-0.45369732,-0.167774,0.41502282,-0.8145266,-0.30325112,-0.106163785,-0.46303123,0.34459832,0.32309216,-0.4294035,0.9724934,-0.9977228,-0.05693229,0.111346364,-0.2956575,0.73004085,-0.5158002,0.2744744,0.75071526,-0.6434885,0.42119685,-0.08924613,0.35917476,-0.14367735,0.9931245,-0.7203146,0.55396163,0.49342817,-0.4563789,0.37071544,-0.13296473,0.033005267,-0.6911719,-0.4681408,0.35532886,-0.39651927,-0.48242766,0.20427406,-0.7111677,-0.14519519,0.14250858,-0.32502228,0.5462188,-0.23681177,-0.08503695,-0.3046477,0.9995984,0.57250863,-0.37093163,-0.015980622,0.07284852,0.5559335,0.99997604,-0.1310306,-0.013153843,0.31931755,-0.26807585,-0.5943766,-0.79241455,-0.9989279,0.28515095,-0.04285744,-0.7957771,-0.19485298,-0.56069374],
    [9,1,"Oc1ccc(C(c2ccc(O)cc2)(C(F)(F)F)C(F)(F)F)cc1",-0.5500886,0.3251913,-0.4669054,0.21755242,0.72831047,-0.6750545,-0.87212986,-0.616094,0.7163898,-0.2639272,-0.28813392,0.3546565,-0.2590059,0.28450656,0.26897714,-0.6347717,-0.7056693,-0.009697451,0.047630783,-0.17050159,-0.41818193,-0.16689603,0.46482673,-0.011926729,0.23110445,0.61735,0.72474134,0.42382887,0.8541625,-0.61575794,-0.1866389,-0.22251545,-0.5516409,0.63631254,0.055234507,0.4404314,-0.35209465,0.30383477,0.99829257,-0.58292127,-0.70621645,0.32003573,0.28020376,-0.04485811,0.6457488,-0.6875823,0.11359752,-0.5973532,0.96142256,0.42163438,-0.2199465,0.5236804,-0.5276132,-0.072360754,-0.8815338,0.414124,-0.84090453,-0.47974116,-0.4680611,0.0902701,-0.24962847,-0.03959928,0.8321768,-0.65447706,0.009101252,0.65838045,-0.155197,0.15539074,-0.36072472,0.46992365,0.05229611,-0.3090442,0.65897775,0.18486834,0.9134146,-0.49818483,0.48764378,-0.39169088,-0.07289028,-0.98857605,-0.8224092,0.5519181,-0.84693414,-0.30936295,-0.2800075,-0.89574766,0.13831128,-0.042742506,-0.41374278,-0.14284967,0.2512254,-0.3079296,0.2506057,0.28677464,0.7880658,-0.35557097,0.53206265,0.07329313,0.16564035,0.5356935,-0.32670155,-0.23985332,-0.49535576,0.62062496,-0.9931461,0.49851587,-0.5224016,0.48738045,-0.9987335,-0.5227874,-0.48754132,-0.16754748,-0.53677374,-0.6349384,0.33664763,0.72017634,0.3973133,0.51289123,0.9945552,-0.11308996,0.06297226,0.051018614,-0.2324355,0.03658609,-0.7396938,0.80271935,-0.33392975,-0.32402116,-0.18010664,0.9999284,-0.50778323,-0.009316911,0.526055,-0.097951755,0.035020966,-0.43197688,0.8128006,0.91042674,-0.848814,-0.39867657,-0.9999788,-0.20307092,0.9741007,-0.002867683,0.84578687,-0.6758451,0.1735009,-0.6250387,-0.8789028,-0.3440809,-0.18681829,-0.69064105,0.27784887,-0.21864921,-0.31294778,-0.08650645,0.30467615,-0.07475866,-0.86574495,0.18575287,-0.80665696,-0.059090562,-0.10734132,-0.41297853,0.2867382,0.70118123,-0.26342636,0.35444352,0.24720271,-0.6472074,-0.91531897,-0.013095804,-0.14996247,0.18566708,-0.34800658,-0.9729124,-0.7987341,0.1733358,-0.3174777,0.09702057,-0.35560027,0.18430187,-0.28572744,0.36737698,0.61489975,-0.26266527,0.59252423,0.752213,-0.2366414,-0.61296296,0.61322635,0.48061073,0.26444495,0.48454222,-0.37799552,-0.13323595,-0.06104172,0.30772597,0.5863691,-0.2503137,-0.54617673,-0.21168724,-0.74916315,0.4084835,0.13905406,-0.006338975,0.83268535,0.15361078,-0.10574845,-0.9998803,-0.58472157,0.7417926,0.3156821,0.011244254,-0.27816597,0.17685032,-0.24449025,0.6077719,-0.72985166,0.44648242,-0.37259635,0.3485837,-0.09750593,-0.2650186,0.9997551,0.11689064,0.5951966,0.11272836,-0.43486756,-0.055619568,-0.6184481,-0.6987104,0.9125415,0.31462884,-0.173471,-0.07517077,-0.73244315,-0.2304352,-0.1345259,0.48199782,0.5847095,-0.32789797,0.16241634,0.17174082,-0.13414817,-0.13967746,0.42488146,0.21060672,-0.24030343,-0.27284175,-0.29946965,-0.9804654,-0.7083965,0.4833429,0.6684472,-0.6441744,0.30544665,0.02344634,0.652182,0.024767557,-0.4275032,0.2422235,0.5851506,-0.59484154,0.3484504,-0.6576692,0.3981272,0.025058901,-0.68248737,0.6871454,-0.81983,0.94177896,0.3102572,-0.17930368,-0.76895154,0.9060089,0.25655955,-0.43562624,0.029127551,-0.84486085,0.45531398,0.9968862,0.008939206,0.48726276,0.31307688,0.43581173,-0.29958275,0.22970243,-0.65763587,-0.7255998,0.14174274,0.919456,-0.2798954,0.8219447,-0.4274357,-0.8404129,0.99996436,-0.997417,-0.14876491,-0.16390099,0.1441022,-0.564626,-0.64122874,0.6803448,-0.25298953,-0.93776,-0.88472664,-0.28752658,0.44546586,-0.40749425,0.529498,0.35505575,-0.08724633,0.11333722,0.75666946,-0.018809421,-0.21145788,0.09713353,0.9445489,-0.30264702,0.018294184,-0.31998104,-0.031931475,-0.121345334,-0.66379464,-0.4609305,0.5297391,-0.94695574,-0.22003567,-0.3438989,-0.018816298,-0.8054239,0.024459707,-0.26609173,-0.8028344,0.91598004,-0.073153324,0.034533523,-0.5252412,0.13105844,-0.5358401,0.56017816,0.6578053,-0.5526445,-0.37639478,-0.51800334,-0.63403064,-0.8070796,-0.41692448,-0.65718615,-0.92861444,-0.24175146,-0.6106002,-0.23670392,-0.396517,0.11297426,0.10928668,0.99990594,0.033533223,0.43790638,-0.27030653,-0.68607086,0.06297158,0.28172886,-0.92877513,0.08445677,0.27582076,0.3166997,0.08466493,0.40336958,0.22136825,-0.21581611,0.8204812,0.54387957,0.36847195,0.99717015,0.08174765,-0.37894022,-0.56189656,0.76970553,-0.6841236,0.15508291,-0.7993056,-0.49955678,-0.81720996,0.23658197,0.6728006,0.69819564,0.07042534,0.6468009,-0.0841486,0.4982736,0.16332825,0.77234286,-0.050417837,-0.6159362,-0.89334273,-0.71432835,0.8672616,-0.4308566,-0.619996,0.2331706,-0.21280055,0.1163225,-0.17138676,-0.5820996,-0.41117656,-0.42539722,0.57989436,0.47462413,0.42883536,0.6706322,-0.19450057,0.79904443,0.4576317,-0.21513957,0.9077206,-0.102295786,-0.981549,0.43588707,0.9995102,-0.8227406,-0.35117224,-0.97535884,0.48096797,0.552877,0.6876029,-0.1319772,-0.23443528,0.47211078,-0.000856783,-0.80474156,-0.48071966,-0.750848,-0.1996965,-0.4782462,-0.16609615,-0.43609068,-0.999988,0.98799884,-0.8018756,-0.24262896,-0.31037945,-0.13001022,0.027921243,-0.86597955,-0.8719085,-0.14525679,-0.83581656,-0.09829786,-0.89485496,-0.054159194,-0.18141012,-0.55362844,0.65314764,0.416046,0.000735581,0.45469564,-0.9999099,0.060000375,0.06553956,-0.44862354,0.21941847,0.5269994,-0.9768744,-0.11794605,-0.76105106,-0.31675747,0.022319514,0.080026224,-0.23974918,0.9308181,-0.52911264,-0.37256065,-0.05080023,0.15060672,0.14326474,-0.8115989,-0.40691423,0.16336419,-0.66812176,-0.6608925,-0.98675585,0.07634105,0.32399866,0.4080805,-0.4737327,-0.33939117,0.2713475,0.83767277,-0.7777422,0.023409182,0.46658897,0.9867643,-0.07072454,0.46995658,0.15215227,0.27047512,0.7582267,0.9841089,0.84197634,-0.54674673,-0.69999367,0.20287089,-0.13339671,0.5882826,-0.99376404,0.18255578,0.58560807,0.5453893,0.4648844,0.008959791],
    [10,1,"CCCCC(CC)COC(=O)c1ccccc1C(=O)O",0.5607926,0.3312411,-0.55312365,0.050058287,-0.454701,-0.17754562,-0.32341188,-0.048134357,0.47419176,-0.0288401,-0.3398731,-0.053955346,0.43717307,-0.6647522,-0.8129222,0.14451484,0.33301073,0.009322563,0.4313789,-0.29041943,0.2556065,-0.5070719,0.12329597,-0.22141019,0.029370748,-0.045051787,0.055874683,-0.4719198,0.033112936,-0.003585086,0.34195766,-0.3613899,0.1995083,-0.45158395,0.5409427,-0.7209627,-0.16825773,0.36841458,0.9908482,-0.12559299,-0.9927541,-0.67555386,-0.25176665,0.41216734,-0.6308664,-0.8842252,-0.5305018,-0.51329947,0.91666126,0.2747312,0.13295333,0.32661083,-0.19742355,0.195746,-0.6857181,0.28946733,0.28905177,0.49975976,0.34859988,-0.16203503,0.3241617,0.3869867,0.49422985,-0.103311025,-0.3371967,0.46277705,-0.43312562,0.13012645,0.5011626,-0.6641856,-0.5191612,-0.8359383,-0.08590641,0.16584575,0.28592983,0.2851723,-0.6330752,0.29683924,-0.45949724,-0.9999409,-0.36439633,0.042275753,-0.9086723,0.17757103,0.73485875,-0.84230965,-0.04817851,-0.27439973,-0.25423354,0.61411834,0.00094473,-0.028713297,-0.31504318,0.26059157,0.99936265,-0.33915347,0.17358299,-0.3117749,-0.71591425,-0.03002749,0.22796264,0.6410906,-0.07027545,0.72711784,-0.82029176,-0.38867363,-0.14467528,0.180706,-0.9447915,-0.027355924,0.7671024,-0.23106585,-0.16950637,-0.394374,0.18996006,0.44872925,-0.012808338,0.72185135,0.99557066,-0.18668158,0.07469755,-0.27107245,-0.52299184,0.11088443,-0.7742571,0.029960932,0.22930057,0.63043797,0.7877188,0.9998559,0.508344,0.19670683,-0.25653693,0.00174425,-0.71957946,-0.8796419,-0.25056332,-0.033470683,-0.6671914,-0.10838906,-0.9888624,0.134231,0.79707074,0.3483187,-0.123593405,-0.1781079,0.27418607,-0.08393882,0.4068357,0.011588672,-0.7336855,-0.7170009,0.2742215,0.16120398,-0.6443211,0.58675015,0.034710504,0.9247308,-0.7438684,-0.76581174,-0.9019693,-0.28962964,0.10807331,0.1963584,0.67835355,-0.021953944,0.22334644,-0.1128039,0.18902063,0.6996964,0.5728084,0.07648587,0.15800032,-0.67755675,0.56743455,-0.97817665,-0.581094,-0.24328044,-0.085204825,0.19633442,0.5448204,-0.98362887,0.10368249,-0.21569636,-0.58152956,0.12353989,-0.18491527,0.04956087,-0.62808275,-0.20736516,-0.7058032,-0.3097807,0.24907424,0.45121187,0.21579939,0.66547936,0.09489525,-0.59545976,-0.004412773,0.75202423,0.77834314,-0.24220793,0.50705093,-0.002609005,0.28315702,-0.46565646,0.39289021,-0.30048037,-0.5739708,-0.99974436,0.6198775,0.4201062,0.3535224,-0.5588201,0.6174881,-0.118706346,-0.7078396,-0.44049907,0.3947981,-0.06488572,0.4596883,-0.20930521,-0.5092145,-0.5464711,0.9777852,0.3064551,0.1448333,0.039317314,0.20923257,-0.4540453,0.13240841,0.39718845,0.4960643,-0.003396513,-0.026915004,-0.000713617,-0.58663076,-0.49984267,-0.17125276,-0.36906952,0.89486104,0.3227689,0.3552459,0.119105496,-0.31021047,-0.46206656,-0.550368,-0.110155635,-0.56569165,0.5012043,0.53441215,-0.9981042,-0.80473775,0.7829356,-0.3741948,-0.53660613,0.2600003,-0.091949925,-0.18561855,0.078156896,0.08942456,-0.005267571,-0.39425692,-0.3980924,-0.11645738,0.7705962,0.016954236,-0.34265083,0.68244714,-0.666774,0.40859002,0.086883396,-0.37402356,-0.27261022,0.010975873,-0.4741902,0.25037038,-0.42435014,-0.21554337,0.7636035,0.3379339,0.9988872,-0.39877722,-0.4095257,-0.3275608,0.42151847,0.029777365,0.10712319,0.26199678,0.3797922,0.5792308,0.99007046,-0.4456041,0.5542303,-0.7386002,-0.62267274,0.9961947,-0.97496766,0.18347444,0.08406453,-0.6681638,0.4342677,-0.62607133,0.22280277,-0.75173247,-0.761234,-0.2944976,0.4802531,0.58549374,0.5069942,-0.47512543,0.10937325,-0.16156016,-0.3186966,-0.54104996,-0.5273941,-0.087649226,-0.52253306,-0.9655478,-0.71001345,-0.084930316,0.7408886,-0.012426158,-0.91575223,-0.1861459,-0.33445975,0.13973421,-0.98233294,0.10658421,-0.34800634,0.27148077,0.20976877,-0.25025228,0.25072,-0.40951183,0.52501774,0.3807683,-0.26108733,0.74472857,0.2194992,-0.5170654,0.49030292,0.4051738,0.6694011,-0.07969651,0.19255665,0.104517505,0.4602948,0.14209701,-0.071389124,-0.98678535,0.698573,0.09525886,0.4502831,0.4865665,-0.27313787,0.19861808,0.9998277,0.022521397,0.043270156,-0.11967692,-0.27461067,-0.007955294,0.028554443,-0.7270736,0.012442317,-0.3283029,-0.4642174,0.38872063,-0.582691,-0.5521279,-0.51229465,-0.47889408,0.6002748,-0.2591144,1,-0.40941826,0.41400135,-0.42184514,-0.27305725,-0.26102224,-0.59588456,0.5296531,0.42547747,0.3500216,-0.17020424,-0.12963654,0.7257892,-0.20615056,0.2645265,0.26157582,-0.562581,-0.047540843,0.32626292,0.63307756,-0.90101475,0.21885733,-0.6313515,-0.7170107,0.2734046,0.5447871,0.48394492,-0.004530781,0.012494483,0.4952161,-0.52102786,-0.62379473,0.15870251,-0.5257669,-0.12543222,-0.31355494,-0.13405351,-0.13537805,-0.7187957,0.50401706,-0.39571455,0.9999504,0.12055147,-0.96473414,-0.1659028,0.9998234,-0.50759405,-0.4275068,-0.9986265,-0.052033667,-0.6063743,0.461458,-0.47340977,0.8323009,0.44320145,0.4605251,-0.53125054,0.105248466,0.50142515,0.001950354,0.07438092,0.120588146,-0.09358953,-0.9999198,-0.99854857,-0.8461125,0.581136,0.001068466,0.4977029,0.43140993,-0.7302783,0.3063378,-0.42020404,-0.099442385,0.09322706,-0.78799844,-0.03418689,-0.55848926,0.31998473,0.18353005,-0.5265264,-0.187407,-0.26903278,-0.99983835,-0.17284866,-0.5139816,-0.2777141,0.41960374,-0.5887982,-0.85620725,0.44113442,-0.18814027,-0.53286517,-0.75087196,0.31359205,0.5101842,0.9455531,0.24126633,-0.23721017,0.6728361,-0.46119052,-0.24651976,-0.5214148,-0.08428941,-0.27014694,-0.32755694,0.20336093,0.3374451,0.14830868,0.23023666,0.18788083,0.27902618,0.2511054,-0.11228143,0.22031163,-0.047462974,0.27512172,-0.6957391,0.9559532,0.040412858,-0.17253308,0.008322847,0.52361596,-0.24354951,0.9999869,0.65933967,-0.48619542,0.17710015,-0.14596237,0.0931663,-0.31254,-0.9647066,-0.376589,0.49050424,-0.12478273,0.41397813,-0.3744648],
    [11,1,"CCOP(=O)(OCC)Oc1nc(Cl)c(Cl)cc1Cl",0.8924424,-0.17919482,-0.7226161,0.32604283,0.37967297,-0.28278795,-0.95732546,0.40325284,-0.5589839,0.14032422,0.16088463,-0.02365387,-0.4463421,-0.4282432,0.3000491,-0.77562594,-0.11677111,0.1670585,-0.5467428,-0.6311358,0.66208524,0.18078087,0.48582345,-0.16955337,-0.7611247,-0.015008509,-0.03209934,0.5572184,-0.18683963,-0.4464916,0.3040452,0.04302705,-0.64316547,-0.37605458,0.5106706,-0.81368953,-0.032108344,-0.4632139,0.99160624,-0.806919,-0.96425307,0.5942351,-0.4597548,0.7024543,-0.5726524,-0.8758822,-0.119419746,0.18084402,0.9884154,0.16361377,0.32574293,0.5415968,0.31822646,-0.010156072,-0.8332278,-0.058039986,-0.6378991,0.32371828,0.322638,0.44127524,0.59613734,0.65611285,-0.049538784,0.12063965,-0.8459298,0.7748546,0.4751712,0.13109569,0.23642375,-0.15736996,-0.59075594,-0.7116371,0.068883836,-0.19094527,-0.3512287,-0.7794016,-0.08703963,-0.023982756,0.44451788,-0.9992754,0.23093458,-0.035837777,-0.89364177,-0.099198885,0.6666066,-0.7594764,0.29362243,0.4455648,-0.17981586,0.14088438,0.15921475,0.08359713,-0.21667196,0.0822119,0.99889064,-0.32635233,0.49311674,-0.10916346,-0.04585721,-0.6415905,0.17712252,-0.601283,0.3791583,0.26020446,-0.8246532,-0.98887485,0.14384817,0.7234491,0.9895668,0.68411237,0.107162684,-0.7198405,-0.37643272,-0.09712638,0.12434231,-0.15063854,0.3584572,0.79420185,0.99815065,-0.13596776,-0.44943777,0.67690504,0.63961786,-0.1945486,-0.5255026,0.20097399,-0.06926774,-0.16311246,0.091851644,0.99961996,0.4718149,0.037626356,0.118873835,-0.57144016,0.11160899,-0.98881096,-0.32309243,-0.2462084,-0.57867277,-0.29580048,-0.99561167,-0.5172492,0.84933585,0.3510715,-0.5619816,-0.81425023,-0.5013744,0.05255714,0.20134012,0.10342178,0.6232332,-0.7944557,-0.1105592,0.41890794,-0.8310462,0.2882587,-0.019396836,0.95859283,-0.85058117,-0.9793163,-0.9172016,-0.74192667,-0.003228802,0.17979825,-0.17937599,-0.037799433,-0.1871321,-0.003705104,-0.5765979,-0.037524197,0.23118822,0.27626795,-0.31317884,-0.30345646,0.437165,-0.51102114,-0.75501657,0.858751,-0.6193195,0.74327475,0.9422125,-0.97057986,0.2135168,0.3339917,-0.14686155,0.10354487,0.67825955,0.40528858,-0.29109278,-0.40386993,0.5255903,-0.09129661,0.1954149,-0.10104389,-0.37890467,0.3438003,-0.23015131,-0.7555375,-0.286623,0.79776454,-0.4921083,0.086503476,-0.70287937,-0.7867329,-0.07252487,-0.70959896,0.7609162,-0.66319567,0.18950242,-0.99946195,0.33906564,0.42499843,-0.6776835,0.16665538,0.35214943,-0.20292109,-0.5263902,-0.17821224,0.44714215,-0.12575667,0.25529453,-0.76713365,0.44668797,0.56608796,-0.9860632,-0.3250433,0.53007174,0.3575524,0.30419874,0.38810083,-0.48644748,0.3571743,-0.36698544,-0.33289376,0.10030598,-0.21599197,0.29199144,0.10371489,0.1395239,-0.48455262,0.8987958,-0.11486678,0.1402471,-0.17925031,0.41847643,-0.35337433,0.6848699,-0.7081215,0.13543485,0.31505758,0.31649917,-0.99829865,-0.29218388,0.5660839,-0.683034,-0.49559426,0.12703443,-0.031335536,-0.83343875,0.13017794,0.14745097,0.31711483,0.41494218,-0.2502957,0.545223,-0.49533913,-0.50845057,0.61980015,0.8706844,0.025296085,0.8442363,0.9913445,-0.4749001,0.3764167,0.60285646,-0.6365748,-0.14535774,-0.10416049,0.38360128,0.19777122,0.06856332,0.9976623,-0.6714999,0.2189539,-0.63287854,-0.4619493,0.64217526,0.8704567,0.89064884,-0.7037002,-0.16817044,0.9954001,-0.44017294,0.79873246,0.18332821,-0.30059057,0.99760574,-0.9712857,0.48777086,0.4826445,0.17764206,0.41808552,-0.6311963,0.03196384,0.2608054,0.6289525,0.5262632,0.6441544,-0.092296176,0.045587163,0.38063645,-0.053665206,-0.037540898,0.006035411,-0.34177524,0.045706574,0.53245616,0.028883867,-0.999972,0.39322558,-0.28620648,0.024606386,0.274055,-0.9406526,0.37097815,-0.4524948,0.3593025,-0.87449545,0.21436034,0.1839567,0.17074218,-0.34662354,0.12638043,-0.51927465,0.15210281,0.49375948,0.4578264,-0.29503953,0.20168677,0.37871033,0.10002198,-0.63641274,-0.4593612,0.4753414,0.3625098,-0.4943992,-0.56340253,0.6377907,0.07881082,-0.047421318,-0.9726292,-0.60094,0.7496358,-0.7144557,-0.37489796,0.042840157,-0.15703322,0.9997048,0.3510048,0.27286968,-0.035502348,0.1529843,0.18296885,-0.33030388,-0.6472347,-0.42925763,0.45363945,0.4101245,0.12351638,0.2678362,0.20128171,0.72454447,0.44951728,-0.3254736,-0.21827199,1,0.55706143,-0.4538501,-0.001544504,0.22647993,-0.35152748,-0.4571502,-0.086866595,0.17265728,0.09152393,-0.5940422,0.16726695,-0.006716575,-0.9093242,0.6138298,-0.046434145,0.26038253,-0.52581227,-0.20497772,0.1752812,-0.8711847,0.2812084,-0.1795415,0.41922364,-0.45852593,0.5410331,-0.064554095,-0.3249801,0.6120567,0.036592644,-0.1118816,-0.119591504,0.45521626,-0.046741836,0.54516447,-0.72706425,-0.002624475,0.7570432,-0.030688241,0.4499172,0.19596668,0.9999999,-0.6049826,-0.9708282,0.20673577,0.99971193,-0.12500294,-0.85756224,-0.9999691,-0.50211304,-0.75964314,0.29504457,-0.46238965,0.3937032,0.03124289,-0.12341181,-0.10498709,-0.30428544,0.76751614,-0.3009955,-0.028505633,0.2871035,0.15747276,-0.9999694,-0.9973929,-0.9662279,0.41952562,0.5394407,-0.52857715,-0.039952964,0.11692409,-0.6321317,-0.2507203,0.14489222,0.8613891,-0.5528701,-0.044414498,0.14610624,0.133066,0.82130533,-0.073382,0.4503286,-0.61090446,-0.9997312,-0.44205153,0.38177004,0.37302676,0.24864884,0.04638801,-0.74005866,0.7374184,0.68074983,0.06638326,0.014305281,-0.81592155,0.27377775,0.9314692,-0.33063298,0.2199959,-0.600309,0.22717242,-0.51546675,0.25890148,-0.50159633,-0.43954456,-0.6486221,0.16976017,-0.9494399,-0.35608163,-0.71643996,0.23450473,-0.3693537,-0.17444883,-0.20356256,0.75675917,-0.809836,0.17584136,0.3951324,0.85161763,0.3144252,-0.11951393,0.012914284,0.21648501,0.020519525,0.9999387,0.8846426,0.02110634,-0.06434163,0.441714,-0.26370576,-0.44111338,-0.9534352,0.1100854,0.11477883,0.5864576,-0.2767249,-0.5679385],
    [12,1,"CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O",-0.68947273,-0.14238532,0.31972033,0.40013006,0.6227769,0.01904592,-0.60724974,0.019514712,0.04684558,-0.14070478,-0.8779623,0.35863256,0.060694195,0.49677378,-0.22369207,-0.6809736,-0.5028709,-0.64967906,0.19453128,-0.32043943,-0.26686832,-0.53969973,0.6770947,0.077286355,0.22154044,0.37143007,0.08281784,0.33166766,0.7374467,0.083876826,-0.74211526,0.7597007,-0.075476125,0.35094193,-0.49679333,0.8631564,0.08711579,0.4782001,0.9805518,-0.82795143,-0.9857091,0.17871787,0.20286787,-0.32929978,0.34229335,-0.9684491,-0.074090794,0.2828187,0.94960886,-0.16637284,0.7197079,0.29939458,-0.5842918,0.25436714,-0.942504,-0.09305975,-0.7539973,0.4415917,0.25637096,-0.054396372,0.36830938,-0.15698038,0.23605622,0.43296295,0.038617577,0.42763048,0.21113637,0.19351721,-0.310356,0.60357857,0.48470348,-0.645524,0.37107807,0.11785931,0.78553224,-0.2894367,0.1582144,-0.44778228,0.10180616,-0.9981301,-0.7493794,0.5240238,-0.70302236,-0.11355966,0.34817505,-0.79564095,-0.35490423,-0.17852655,0.20428862,0.1337536,0.15164775,0.34015894,-0.3033687,-0.5154499,0.80202335,-0.16599232,0.5661404,0.43328536,0.52717143,-0.23057373,0.030104097,0.19414127,0.34724656,-0.6354342,-0.64043736,0.4336944,0.11043018,0.37864548,-0.9996308,-0.29893538,-0.4285766,-0.17833714,-0.003948392,-0.45118752,0.5797823,0.71940756,0.65375054,-0.21424283,0.9989131,-0.42589775,0.3603724,0.07301011,0.07449511,-0.1619892,-0.55449617,-0.33352605,0.10810797,-0.018588634,-0.5052442,0.99989295,-0.5881011,0.11026557,0.23288727,-0.01994565,-0.35528642,-0.13247973,0.44966948,0.85656035,-0.8151605,-0.6166185,-0.998203,0.8223422,0.9913252,0.6287035,-0.3371859,-0.42597297,-0.31245595,-0.8217574,0.726294,-0.61989754,0.09384224,-0.8356538,0.17803937,0.576091,-0.19353357,-0.14371368,-0.33778432,0.9701905,-0.9380622,-0.29661742,-0.97170764,0.42831147,0.05829553,0.1621359,0.52119184,-0.23942995,0.74805033,0.1048884,0.4172638,0.22039579,-0.8889111,0.17038389,-0.21966943,0.03621869,-0.052445382,-0.9779096,-0.8641361,0.58116955,-0.36789334,-0.009193522,-0.0749713,0.16422647,-0.41616365,0.03286516,-0.332077,-0.35211238,0.25152525,0.2546616,0.12270083,-0.6010063,0.7972227,0.5805421,-0.09707979,0.72012216,-0.034619246,-0.62194437,0.69856995,0.035346486,0.03895462,-0.28903806,-0.52203184,0.19702546,0.18763505,-0.58086777,0.08870217,-0.5743548,0.5752001,0.10017267,0.5353846,-0.99865294,-0.4144043,-0.120599665,0.58416814,-0.13196339,0.8038047,-0.1692486,0.21603377,0.2742321,-0.73775584,-0.31496122,-0.26540914,-0.7393727,-0.3776856,-0.31418303,0.99998343,0.18162365,-0.38346604,0.25219578,-0.071292296,-0.23089844,-0.17983381,-0.09003465,0.7209704,-0.113191485,-0.16383077,-0.303259,0.17471756,0.4299687,-0.27243602,0.16908222,0.8667676,0.73184806,0.12676202,-0.84587514,-0.08655586,-0.29109907,-0.18798551,-0.09555639,-0.4360477,-0.011753452,-0.113059506,-0.99847597,-0.76273954,0.6255793,0.44682556,-0.76615304,-0.6648969,-0.03910678,-0.25774774,0.35493362,-0.5598017,0.60086006,-0.15063635,-0.4045055,0.80770767,-0.46318403,0.19686858,0.2989815,-0.7704144,0.4939176,-0.50351375,0.6923501,0.4500403,0.4256577,-0.60687107,-0.36291733,-0.4019658,0.3096211,0.38145295,-0.8484662,0.6156973,0.9992775,0.18915644,-0.2406701,-0.29586518,-0.4976177,-0.012979148,0.070418544,-0.28152218,-0.13964418,-0.1678754,0.9964263,0.26751438,0.93264824,0.026430268,-0.36547738,0.9984594,-0.99598634,0.21530275,-0.2001803,0.39889374,-0.2432459,-0.5908157,-0.5823469,-0.2824961,-0.9023131,0.7541902,0.23776314,-0.2738345,-0.21839443,0.52406204,-0.7298873,0.11690577,-0.029158523,0.8312916,-0.5536397,-0.1501184,-0.5621854,0.8188506,0.4516605,-0.2669623,-0.12631465,0.78053325,-0.73480517,-0.3559176,-0.22974713,0.18927905,-0.962201,0.21449474,0.24694148,0.3113276,-0.25926152,0.2282698,-0.24403797,0.13555312,0.8515986,-0.062018324,-0.12157915,-0.13159692,0.26465833,-0.34606358,0.3127053,0.40993688,-0.49554408,-0.08754116,0.06278444,-0.29951242,-0.745532,0.13076593,0.39333165,-0.9854779,-0.42603534,-0.66772026,-0.46372288,0.45832595,-0.32751322,0.38335678,0.9997553,0.24989492,0.008815031,0.35713422,-0.09309234,-0.41863683,0.46818462,-0.8714962,0.15732086,0.31125185,0.42736697,0.33132562,0.24631855,0.41439757,0.05294416,0.72301227,0.7644404,-0.12781036,1,0.4768483,-0.49761662,-0.2336342,0.048464466,-0.8671706,-0.21100691,-0.68091977,-0.51258796,-0.3048041,-0.39535168,0.054190498,0.5646862,-0.03512713,0.7967639,0.23312354,0.10273575,-0.057480853,0.21844341,0.56190836,-0.86103404,-0.4191475,-0.029264979,0.8752882,-0.14226976,-0.8697156,0.5727763,-0.26870617,0.27388984,0.29235667,-0.23517655,-0.59960127,-0.7325193,-0.69544387,-0.095223986,0.31351098,0.50120574,-0.36723188,0.22202833,-0.08417103,0.3739187,0.97599083,0.4143471,-0.996994,-0.30824676,0.99974704,-0.69970655,-0.3706941,-0.98944896,-0.44220805,0.5113512,0.5798758,-0.6702651,-0.7844339,0.38259006,0.26663166,-0.8618261,-0.73771644,0.06252682,-0.5996769,-0.17991333,0.04833695,0.25976595,-0.99996734,-0.9986987,-0.9775696,-0.5306819,-0.38209355,0.667446,0.024824506,-0.88145745,-0.780359,-0.3334845,-0.52409345,-0.16773413,-0.8771422,-0.4146579,0.24721776,0.08385139,0.7627455,0.5311027,-0.27940965,-0.7924117,-0.9999509,-0.47328287,-0.16369997,-0.015151576,0.34148806,-0.34322658,-0.9883565,0.65562576,-0.69880426,-0.4727537,-0.1872678,0.25716013,-0.28795955,0.9548257,-0.4731143,-0.16052249,0.48949862,0.42616656,-0.3734288,-0.8389128,0.055607546,0.4966545,-0.63179755,-0.25783256,-0.75121003,0.26594812,0.014047842,-0.6374471,0.40799478,-0.50106686,0.3091533,0.7508982,-0.25199267,0.07843735,-0.11113209,0.620453,0.5426416,0.35945725,0.24353233,0.10208005,0.41111743,0.99943566,0.39378437,-0.12517825,-0.5244516,0.36315072,0.41548452,-0.32054916,-0.9003508,-0.4222716,0.34423083,0.76959103,0.71682614,-0.4407689],
    [13,1,"CCc1nn(C2CCCCC2)c2cc(C3(C#N)CCC(C(=O)O)CC3)ccc12",-0.84869784,0.45683652,-0.16236024,-0.84896296,0.21982539,-0.16887856,0.67817557,0.14250012,0.10554772,0.3137624,0.10527287,-0.22426271,0.07092126,0.04106894,-0.42398712,0.5064813,-0.5441011,0.1306649,-0.2483883,-0.4488752,0.7239196,0.58882415,-0.11734128,0.06790352,0.09913824,0.22870237,0.57525426,0.050659854,0.1294153,0.66215026,-0.26473883,0.32847342,-0.13193455,0.15330929,0.29524922,-0.6340804,-0.4250251,-0.034356862,0.99966455,-0.38870272,0.10784708,-0.32957432,-0.12215234,0.4643705,0.37183526,0.63934124,-0.16909051,0.46522853,0.08944296,-0.21047689,-0.10269412,0.6276267,0.24683233,0.52049744,-0.67142606,0.5769803,0.064760774,-0.83243966,0.087763906,-0.73188466,0.6561018,0.462875,0.55409425,-0.4516506,0.4910333,0.2031959,-0.40196466,0.3974472,-0.21106903,0.057936355,-0.9449477,0.16556582,-0.3713076,-0.43286598,0.7162235,0.37231323,-0.053132374,-0.29035404,-0.24432926,-0.9993863,0.13344991,-0.10555022,-0.9378109,0.29915002,-0.19052108,-0.97421306,0.25200245,0.74589795,-0.7507685,-0.1940271,0.05108745,0.6292692,-0.8745816,0.22519183,0.99803126,-0.25181192,0.71399254,0.14020859,-0.50525284,-0.010952273,0.40248603,0.4496427,0.2672377,0.9123068,-0.99938864,-0.55136687,0.007153091,-0.63776606,-0.96919876,-0.69433653,-0.10755007,-0.78485876,0.29393613,0.8520302,0.47554854,-0.3936342,-0.26190576,0.449298,0.8636527,0.29066876,0.43708235,0.44299564,0.055683386,-0.18301655,-0.24811055,0.047508728,0.06825115,0.28260756,-0.16667236,0.9999611,-0.9241471,0.41985303,0.31970003,-0.2485265,-0.29163492,-0.9680093,0.3175997,-0.08633487,0.0957451,-0.3160421,-0.9999988,0.60322434,0.28957242,-0.28333822,-0.2522338,-0.57345146,-0.096401095,-0.019944632,-0.9953562,0.06612651,-0.461787,-0.5623291,0.78965074,0.8024004,-0.62146527,0.003806621,-0.083708294,-0.9403614,-0.3385099,-0.70005745,-0.18929428,-0.40148643,0.037029795,-0.31894496,-0.40539327,-0.18604013,-0.2702792,-0.75742644,-0.3232317,0.41201577,-0.5514038,-0.63908046,-0.24565372,0.055477787,0.8004938,-0.6888668,0.94420487,0.6754313,-0.22030541,-0.45778722,0.07381733,-0.96064806,-0.5287448,0.06793019,0.77367234,0.05024006,-0.00069382,-0.0295057,0.25312993,0.3912797,-0.095345825,-0.3755398,0.45261586,-0.16871786,-0.5418197,0.4077714,-0.36267826,0.006136884,-0.07391953,0.79816383,-0.17182435,0.38037297,0.36611533,0.4453118,-0.064395316,0.5281663,0.0799813,-0.33225057,-0.73649395,-0.999937,0.45477083,-0.4093747,0.23045696,-0.4314247,0.1444331,0.2355557,-0.84085,0.2263363,-0.44489625,-0.5445934,-0.12616676,-0.57695717,-0.45011118,0.42599612,0.9927496,-0.1513076,0.38515088,0.08835036,0.32274935,-0.0843435,-0.27650836,-0.43318313,0.5015081,0.73816705,-0.24398738,-0.2216372,-0.80118245,0.3440485,-0.8687164,-0.24585992,0.895046,0.61050487,0.66458344,0.17140552,-0.76691467,-0.60423136,-0.53500265,-0.17619644,-0.614646,-0.5107698,0.103761986,0.014251859,-0.18307717,0.17687288,-0.4636638,0.25202763,0.6597899,0.26806948,0.1191152,-0.38649523,0.33894262,0.76609516,-0.35950652,-0.4696445,0.14286312,0.22167172,0.6963029,0.48660666,0.9668326,-0.66675395,-0.048615806,0.99711275,-0.060237925,-0.18030325,0.5522581,-0.21520033,0.42190194,-0.7822848,-0.43687204,0.27907023,0.70412254,0.9663393,-0.014379106,0.30627966,-0.33836615,0.5402132,0.5728622,0.776152,-0.28693414,-0.032615885,0.36971986,-0.2330353,0.4470571,0.19834433,-0.28880236,-0.18950011,0.99999905,-0.99535376,-0.38471946,-0.014744124,0.39535448,-0.63315433,-0.78314626,-0.11421168,0.61196035,-0.39510623,-0.99776065,0.12269543,0.6089473,0.8127769,0.373462,0.019980235,0.3933699,-0.46788988,-0.19556198,0.4103038,-0.84160423,0.49348113,-0.9451903,-0.540284,0.74351335,0.5255659,0.31192112,-0.8022612,-0.008065713,0.12185479,0.62774664,-0.9748633,0.70584214,-0.38367856,0.30356374,-0.43878275,-0.001613833,-0.000112824,-0.16781399,0.88665545,-0.12831008,-0.28632966,0.648782,0.5611075,0.20096864,-0.42699474,0.56019205,-0.39614293,0.000945806,0.022832423,0.30453217,0.12992395,0.31440657,-0.9655858,-0.55025506,0.119760826,0.5157631,-0.034973048,0.1609519,-0.104976684,-0.2864807,0.99941057,-0.3452429,-0.59558904,-0.075251795,-0.26899782,-0.22159821,0.08782406,-0.77890545,-0.80884284,-0.70799446,-0.018322524,-0.14171265,0.38023582,-0.41159838,-0.05408288,0.4545808,-0.7228336,0.10853805,-0.99999976,0.019934325,-0.111762136,0.56700116,0.5218825,0.28317484,-0.15373647,0.24529028,0.5168872,-0.13838026,0.018381968,0.4026474,0.38694212,-0.7617549,-0.15838933,0.21204461,-0.7616475,-0.531886,-0.24855281,0.31511724,0.13216554,-0.1636643,-0.58746785,0.38228908,-0.4653771,0.7651739,0.7802181,0.22965156,0.40608805,-0.21301444,-0.88740057,0.13384612,0.4324421,0.24559316,0.30953142,0.43936765,-0.01649091,0.1612475,0.112708315,0.123913445,-0.29086933,0.9998013,0.6385923,-0.988162,-0.26497018,0.9983842,-0.30080917,-0.12714438,-0.99870306,-0.045464825,-0.57290184,0.70572895,0.6122942,0.01693453,0.33482122,0.06480204,-0.8970035,-0.14021507,-0.4647651,0.73999965,0.47662866,0.016430944,0.11458074,-0.9996927,1,0.50176436,-0.45605123,-0.023409244,-0.6511622,0.6418532,-0.56288254,0.12575844,-0.35129443,-0.4118698,-0.3699202,-0.25848335,-0.22420086,-0.19162296,-0.20182262,0.2567195,-0.3238967,-0.33331856,0.9751684,-0.99875265,-0.11224933,-0.5126349,0.14459018,-0.6291835,0.3386524,-0.70994234,0.44342425,-0.44497618,-0.023383152,-0.6422455,-0.60153955,-0.14117023,0.97264373,0.07584269,0.5546567,0.29236385,-0.20474489,-0.27405542,-0.1621065,0.3446441,-0.3236129,0.57183695,-0.1413838,-0.5758132,0.3797176,-0.30771548,-0.662149,-0.08718104,-0.121416464,-0.24496791,-0.77228415,0.48735037,0.7483221,-0.12644958,0.9992542,0.56402916,-0.502146,0.25246543,0.8485749,0.21532144,0.99979085,0.8188929,-0.6627636,0.39576852,-0.06373068,0.6842689,-0.14876218,-0.99877995,-0.55636793,0.3883771,0.05478198,0.56816417,0.29610643],
    [14,1,"CC(C)(c1ccc(O)cc1)c1ccc(O)cc1",-0.7831542,-0.27417985,0.16111556,-0.15751016,0.65648764,-0.3926053,-0.5959313,-0.16445397,-0.04864097,-0.08020376,-0.8592308,0.008883532,-0.016896147,-0.6485651,-0.35933873,0.63212115,-0.22093111,-0.26177135,-0.07209744,-0.1832113,0.1546554,-0.77924526,0.5523734,-0.16064858,-0.06673379,0.36926314,0.15890767,-0.12769307,0.86899453,0.124954835,-0.35013783,0.12205057,-0.012777688,0.4226353,-0.26153296,-0.031355392,0.2969504,0.510484,0.9671124,-0.8861661,-0.94397527,0.001034194,-0.27863622,0.048653893,0.33536142,-0.9729575,0.14657599,0.004296656,0.92260635,-0.47710288,0.7156634,-0.1342425,-0.4229947,0.21301007,-0.9145044,0.19681565,-0.6868309,0.7190878,0.36541063,0.00585926,-0.3004559,-0.44990766,0.37872946,-0.09649131,-0.19073975,0.4418105,-0.12430338,0.5086684,-0.2181631,0.40127018,0.4070901,-0.87785,0.027653472,-0.000380129,0.7813232,0.076539405,-0.039573867,-0.42383322,-0.5062812,-0.9972007,-0.9113495,0.5341352,-0.82430303,-0.23353332,-0.0569502,-0.7641119,-0.2863379,-0.3313068,-0.2006979,-0.45778185,0.4176569,0.025476731,-0.014909674,-0.30859667,0.7294824,-0.077320755,0.639898,-0.058960136,0.52108896,-0.14731137,0.058971565,0.24776296,0.07395656,0.8160239,-0.64996994,0.46325815,0.18431182,0.5294136,-0.9985839,-0.10192999,-0.13288194,-0.3611107,-0.1134615,-0.024584316,0.18869305,0.6819598,-0.20622355,0.34822127,0.99843043,0.27004096,-0.274613,-0.58895457,-0.50629145,0.1562873,-0.7344811,-0.085156076,-0.37823662,-0.30522296,-0.5432052,0.9997682,-0.45602375,-0.001439041,-0.19404136,-0.14806457,-0.34539226,-0.54624414,0.47459304,0.8515724,-0.84023815,-0.5067772,-0.99993324,0.503695,0.9860857,0.18051897,0.0892696,0.010703781,-0.11313409,-0.3583589,0.6650994,0.3273543,0.31104955,-0.853649,0.34855852,-0.01072052,-0.28256315,-0.024407713,-0.078847244,0.9656263,-0.75532424,-0.15412383,-0.9823705,0.34090853,-0.16476306,0.20279624,0.15859725,0.2590055,0.78407305,0.5023792,-0.2620857,-0.19889866,-0.4030251,-0.19041488,0.43798873,0.17683335,-0.2892805,-0.9857925,-0.79114014,0.3805782,-0.38349277,-0.4481063,0.020411951,0.045822997,0.055377897,0.59055483,-0.30358264,-0.046743758,0.28388253,0.2698414,-0.16051702,-0.24090837,0.50264585,0.011928369,0.24713196,0.6249344,0.29455614,-0.7673228,0.07600292,0.5900366,0.33677962,-0.1283259,-0.6669945,-0.24089429,-0.21751814,-0.04960999,0.3264062,-0.034794834,0.30770332,-0.11755331,0.32265854,-0.99899876,-0.5448271,0.25258622,0.3598516,-0.1740698,0.6181532,0.25011304,0.06342501,0.56091386,-0.54546654,0.33221257,-0.052890792,-0.44754383,-0.33313537,-0.36361602,0.99997306,-0.017355556,-0.15672767,0.36587313,0.23916481,0.3729631,-0.38086268,-0.6304946,0.7436702,-0.19244444,0.40713,-0.41431126,-0.1572708,-0.11014096,-0.03566262,0.32977223,0.8222743,0.4793574,0.17571358,-0.7653188,0.6052402,0.494441,0.6003869,0.32916594,-0.2630431,0.09541723,-0.3099934,-0.9741584,-0.37968883,0.4436642,0.6212403,-0.39101925,-0.5931729,0.13874951,0.75600445,0.08278414,-0.6031368,0.6210361,-0.36475238,-0.48631385,0.34154913,-0.031954758,0.5140983,0.4732194,-0.8576925,0.28439286,-0.63751316,0.63617104,0.22251335,0.08401884,-0.13086796,0.42103356,0.1227143,-0.24513498,-0.067761295,-0.39767033,0.57076186,0.9994875,-0.031878147,0.38656217,0.017054467,0.12122333,-0.2810861,-0.2553566,-0.289422,-0.13029686,0.4570505,0.99662024,0.17136742,0.3853426,-0.14864647,-0.3858238,0.9999866,-0.99111134,0.5897179,-0.13471496,-0.021562953,-0.34866482,-0.41161364,0.024953227,-0.24675877,-0.95872897,0.6303843,-0.09642996,0.3770611,0.08029773,0.3422427,-0.37569073,0.11396381,-0.42395347,0.79402274,-0.38310713,-0.28931338,-0.19969282,0.94399416,0.34216624,-0.26430967,-0.071827754,0.47108272,-0.665105,-0.6125788,-0.14288838,0.26751372,-0.9145939,0.3379981,0.088855326,0.5428446,-0.03002676,0.5046613,-0.4660779,-0.16894184,0.65915364,-0.14407524,0.38935468,-0.2886302,-0.057031635,-0.55519223,0.121222705,0.3025738,0.43929392,-0.24531391,0.012977675,-0.5832355,-0.67396396,-0.38483545,0.45023978,-0.9908072,0.10426143,-0.56533587,-0.180735,0.2118248,-0.11111833,0.4630599,0.9996011,0.0982474,0.027646342,-0.08790421,-0.053618528,-0.64179707,0.25487235,-0.8863225,0.2813167,0.05321294,-0.19164066,0.19195063,0.33455265,0.62279403,0.50983614,0.49405426,0.8639786,0.6201752,0.9978036,0.44098672,-0.09707586,-0.302309,-0.064649515,-0.81515837,-0.2835952,-0.5160321,-0.71895766,-0.26765582,-0.14395294,0.64659935,0.2071712,0.15481041,0.5562192,-0.072940804,0.48263007,-0.035982195,0.3589645,-0.08257069,-0.12338221,-0.6527525,-0.18746369,0.6767334,-0.19392596,-0.87214655,0.26963204,-0.26404926,0.23330998,-0.49154833,-0.31850833,-0.62391114,-0.724849,0.035382155,-0.008150905,0.24426211,0.5171411,-0.49612394,0.46973714,0.29366967,-0.41366032,0.92763305,0.26039946,-0.9847481,0.082419425,0.9995117,-0.54661953,-0.14673395,-0.97093856,0.14290969,0.35606378,0.5894175,0.20536384,-0.68519145,0.7627614,-0.55344343,-0.4868302,-0.48990014,0.021733273,-0.49833483,-0.12644929,0.07296123,0.12520564,-0.9999842,0.99008113,-0.93134356,-0.06578978,-0.42919996,0.3498979,0.030825004,-0.81709874,-0.5824383,-0.12861593,-0.43411216,-0.13840677,-0.8672482,-0.5542695,-0.024100302,-0.42859197,0.31734785,0.08136895,-0.17099017,-0.77658224,-0.99995494,-0.48348442,-0.3965394,-0.1411537,0.33834347,-0.3866501,-0.98844093,0.25661305,-0.7671396,0.11321856,-0.19729911,0.038049873,-0.15782684,0.965611,-0.55789316,0.09558405,0.4811123,0.4479432,0.06559336,-0.9336188,-0.22037059,-0.5114625,-0.0880851,-0.05852332,-0.7483584,-0.12197779,-0.024415102,-0.63535565,0.094835006,-0.7133894,-0.032887515,0.6000103,-0.47463313,-0.31781057,0.46739277,0.7567632,0.11384329,-0.17849211,0.23776937,0.13294204,0.17495304,0.99970114,0.64796627,-0.03666491,-0.39427063,0.32209626,0.05401778,-0.20447852,-0.914181,-0.15061921,0.6651106,-0.2394705,0.51310855,-0.24322079],
    [15,0,"CC(C)Oc1cc(-n2nc(C(C)(C)C)oc2=O)c(Cl)cc1Cl",0.05274089,-0.24641265,0.09384801,0.47770962,-0.19123396,0.15484576,-0.21571596,0.74771047,0.39202285,-0.008381607,-0.4641143,-0.04414874,-0.2529772,0.7347389,0.41442493,-0.86231446,-0.103770316,-0.8259265,-0.22953518,-0.39396137,0.01472018,0.1797117,0.40522864,0.10709512,0.13477026,0.20097625,-0.15648703,0.16457815,0.048296146,-0.3159159,-0.63184494,0.65606505,-0.043643594,0.40418255,-0.03070028,0.68720233,0.16087684,0.11571444,0.9986594,-0.5533963,-0.974839,0.17936336,0.10343497,0.6689978,-0.38231227,-0.4214356,-0.63189375,-0.23300195,0.6050934,0.056788743,-0.12875557,0.6341312,-0.27478588,-0.10884174,-0.22458558,-0.018159634,-0.6033753,-0.73717463,-0.08864827,0.23948978,0.512783,0.061938804,0.5387739,0.70785755,0.15823631,0.21341394,0.41127586,0.4650387,0.5652979,-0.19299953,-0.8667831,-0.84518224,0.44650897,-0.7937099,0.45548183,-0.7993727,-0.036461756,0.43663132,0.37362576,-0.9990644,0.4644748,-0.052154552,-0.92597795,-0.27346694,0.180365,-0.86618257,-0.33698487,0.3011913,-0.6458198,0.2557913,-0.2697103,-0.5104738,-0.40927067,0.22409642,0.9985466,-0.56145257,0.67733324,-0.35963184,-0.01536331,-0.29179135,0.2487334,-0.30918646,0.23904929,0.29498452,-0.99005944,-0.9645272,-0.21670926,0.5852284,0.9666336,0.45537585,0.23738919,0.07359526,-0.30635366,0.14549555,0.047965594,0.2247359,0.3113747,-0.042147685,0.9912691,-0.5620483,0.004165368,0.001835191,0.25224313,-0.12171479,-0.023553675,-0.33173722,0.7705841,-0.45397186,-0.22619106,0.9997969,-0.4903142,-0.6190312,0.58634585,0.07922264,-0.07905066,-0.99160296,-0.25697264,-0.10749616,-0.50978875,-0.63957864,-0.9999003,0.34595832,0.8197268,0.15695569,-0.17592086,0.28375313,-0.66962683,-0.7372771,-0.681286,-0.37468123,-0.33568883,-0.5336571,-0.5474654,0.028145732,-0.2544727,0.45256776,-0.18207927,0.3264861,-0.8710116,-0.7961044,-0.76376975,0.7409659,-0.6656947,0.2637103,-0.13011964,-0.21041057,0.75206745,0.40167826,0.05131158,-0.32441032,-0.36817485,0.1299107,-0.1461007,-0.6989999,0.02135367,-0.14059292,-0.55908716,0.065508604,-0.46356875,0.7896906,-0.028617276,-0.8470301,-0.64887834,-0.18374626,-0.12751646,0.39682075,0.51868105,0.581071,-0.13679624,-0.6035826,0.07923099,0.53504026,-0.5649614,0.10055563,-0.30758008,-0.4669236,0.12663743,-0.8843504,0.10847174,0.15484697,-0.9002045,-0.56471616,0.030028906,-0.31246063,-0.025147501,-0.3254907,0.6761937,-0.38984224,0.36896873,-0.99974954,-0.5328941,-0.333965,0.64654154,0.262432,0.2826895,0.43791333,0.05467581,-0.19562107,-0.37750065,-0.25271696,0.2501476,-0.3303962,0.7739202,-0.14375736,-0.85563344,-0.6095821,0.021821428,0.28079873,0.37778035,0.24096353,-0.68890446,-0.11038345,0.521173,-0.5388731,-0.06844718,-0.11774976,0.37258136,0.20556623,-0.6472996,-0.033309635,0.845371,-0.36220333,-0.27430347,-0.59346193,-0.14040698,-0.5905672,0.3929425,-0.34409022,0.15815467,0.6860169,0.32115886,-0.97702265,-0.6440624,-0.22745796,0.004582854,-0.5742483,-0.5419451,0.10239626,0.24195261,-0.43412057,0.26144367,0.23764265,-0.11272004,-0.53591,0.6025591,-0.5163586,0.2763575,0.79965824,0.60147417,-0.110961035,0.5273182,0.97628856,0.028620612,-0.40132627,-0.4902663,-0.5769541,-0.4204978,0.17569953,0.2672013,-0.6547163,0.37437403,0.9956082,0.047460563,-0.37705693,-0.68093574,-0.21645428,0.6340469,0.9269042,0.9110929,-0.2329949,-0.07766149,0.94917345,-0.2697074,0.89366126,-0.4607317,-0.30165693,0.99996465,-0.99048215,-0.1022576,0.2438365,0.52546513,-0.09745071,-0.44520375,-0.43288842,0.7046237,0.7059159,-0.874768,-0.06248944,0.1387107,-0.24286775,0.5236358,-0.3244955,0.29126835,-0.38183227,0.304608,-0.38117796,0.7523194,-0.30995858,-0.9999163,0.40732214,-0.048721705,-0.19353439,0.852154,-0.624824,0.66650283,0.322122,0.1852236,-0.865278,0.58266276,-0.22150691,0.10104291,-0.5071221,0.2959856,0.47967136,-0.27966902,0.44928932,0.18486944,0.54766107,-0.03923853,0.4116711,0.15489565,-0.56825936,-0.023057615,-0.37818143,0.56355953,-0.16857465,0.19275716,0.11255858,-0.6413438,-0.6954933,-0.90791214,-0.14506623,-0.12282701,-0.7344533,0.14659064,-0.34030604,0.48824894,0.9995948,0.17193083,0.3364197,-0.2771448,-0.648727,0.30527458,0.47376978,-0.666569,0.66080767,0.59434193,0.4031577,0.4472191,0.34619075,-0.4332726,0.33486745,0.62471,-0.65383595,-0.26254597,0.9982385,0.16164295,-0.27421105,-0.48333046,-0.110326655,-0.13484511,0.003602102,-0.5626278,-0.7234167,-0.511518,0.28384346,0.33275795,-0.13415241,-0.50743634,0.7353899,-0.34592822,-0.22850783,-0.38228467,0.67188257,0.6244561,-0.57226485,-0.2491776,-0.16459057,0.53786063,-0.3087595,0.5897746,-0.41148558,0.12508152,0.58666253,-0.070021935,0.10409448,-0.62732613,0.14701027,0.07238468,0.061198264,0.2127251,0.51517683,0.2688543,0.7216727,-0.17059292,0.6860245,0.9999995,0.49707675,-0.9776376,0.11832097,0.9996915,-0.5349793,0.14695427,-0.9999035,0.07169719,-0.7394992,0.56407446,-0.65828687,-0.20548637,0.3649552,-0.3282351,-0.5135705,0.24992988,0.016914317,-0.051294357,-0.5762485,0.27646413,-0.5495399,-0.99996334,0.9935074,-0.6491957,-0.28401843,-0.3105974,-0.4398082,0.14160042,-0.3685457,-0.73865193,-0.5144943,-0.2858102,0.23645091,-0.44795936,0.16265368,0.12379214,-0.25291184,0.4955485,-0.34058136,0.17232814,0.47846857,-0.9997965,0.43799055,-0.2171414,0.44112852,-0.1881817,0.16829596,-0.80406064,0.7652143,0.5087352,-0.3562708,0.5042387,-0.14587983,-0.3685738,0.9734246,-0.26155204,0.5713928,-0.54146695,-0.102987565,-0.78298134,0.15932551,0.009249309,-0.1434213,0.13429876,-0.35970968,0.15071663,0.56321347,0.33107743,-0.31246337,0.1351809,-0.24798796,-0.1488985,0.7675753,-0.65309596,0.23370086,-0.7920652,0.984205,0.6236398,0.1103136,0.24386784,0.39323696,0.17942914,0.9998538,0.4215828,0.30011123,0.28470364,0.46112403,0.19873463,-0.35874423,-0.99300385,-0.7071924,0.58625454,0.18927905,0.2472571,-0.26331562],
    [16,1,"OC1CCC(C2CCCCC2)CC1",-0.68652993,0.3751855,-0.19232945,0.5457346,0.20224515,0.08257206,-0.54846114,-0.16409265,-0.29022154,-0.15657668,-0.6475722,0.14354794,-0.24496923,0.40322903,0.0595543,0.5330152,-0.06192053,0.15040533,-0.22853671,-0.36266264,0.25731668,-0.52354395,0.08956182,-0.30539393,0.28559253,0.025650013,-0.2815125,0.023282876,0.43046206,-0.4104614,0.09586424,0.6465679,0.20199002,0.61777794,-0.07156635,-0.20258754,-0.5048825,-0.3326119,0.22355518,-0.9141781,-0.97296053,-0.46107945,-0.07382408,-0.3455294,0.10314447,-0.9939848,0.2292306,-0.12396028,0.9034574,-0.3787254,0.66913867,0.08899683,-0.06286143,0.4255753,-0.8757397,-0.37585706,0.47593394,0.9652785,-0.21898812,-0.35030854,0.06369321,-0.57899106,0.5563244,-0.10628341,0.47997665,-0.058660872,-0.3783811,-0.1682848,-0.21463527,0.3334541,0.39319512,-0.77930135,-0.098923184,0.88904446,0.44027826,0.13218296,0.13971655,0.35107478,0.26596823,-0.997604,-0.46728307,0.30962986,0.4826012,-0.3932879,-0.5415281,-0.6024662,-0.02577583,-0.040772114,-0.21340652,0.00737872,-0.2156811,0.5593262,0.28267238,-0.044068746,0.47314873,0.09392072,0.6957864,0.1026644,0.35797453,-0.38893253,0.10331074,-0.32074016,0.061362423,0.8510763,0.8076182,0.6395727,0.29822057,0.398296,-0.8048119,0.25064316,-0.23024611,0.045074154,0.31249908,0.09042709,0.39044455,0.1497587,0.21100092,0.2238552,0.99834335,0.5239516,-0.20488162,0.050687946,0.28675222,0.08080526,-0.16043217,0.5856778,0.111349635,0.04132261,-0.29522273,0.999835,-0.18120441,0.48517022,0.42037684,-0.5551482,-0.26593837,-0.47014102,0.33892202,0.68816787,0.046224665,0.21238397,-0.9999192,0.2184675,0.99361664,-0.326976,0.35118344,-0.57645947,-0.12530749,-0.40205762,0.9840566,-0.12873514,0.18786807,-0.64750814,0.84236044,0.75657415,0.001752862,-0.44832754,-0.1027666,0.9971761,-0.10661635,-0.3772231,-0.9887975,-0.10650163,0.17674999,-0.37214524,0.3134357,0.01454228,-0.5645506,-0.3003113,0.05760438,0.052386723,-0.2980333,-0.41573918,0.5181806,-0.011273267,0.538085,-0.9875796,0.9808019,0.44423774,-0.13436458,0.019769445,-0.080850504,0.6644105,-0.1958676,0.6947814,-0.8791595,-0.15979142,0.18376793,0.25767893,0.02341359,0.70018643,0.000527602,0.47849843,-0.16890615,0.34294522,-0.32315207,-0.23550929,0.16860616,-0.48696133,0.6617634,0.36047816,-0.58400524,-0.573899,-0.589092,-0.2779903,-0.071222745,-0.17360209,0.021551484,-0.44582194,-0.1768639,-0.9688563,0.15875565,-0.09626637,0.5716337,-0.78380275,0.17761114,-0.52186775,-0.6381493,-0.031777274,-0.215826,-0.096432306,-0.19151597,0.58345896,-0.6196946,0.044161238,0.98298776,0.51551616,-0.06352764,0.20604959,-0.113145836,0.29051015,-0.4469608,-0.56037164,0.7007051,0.11986795,0.06374179,0.4436436,-0.5455751,0.5266027,-0.11378531,0.63372517,0.9010671,0.066251986,0.225365,-0.104092084,-0.7534875,-0.09001118,0.19956729,-0.4823098,-0.36528182,-0.5734093,-0.1852296,-0.9624645,-0.4207309,0.63419145,0.22425337,0.38373885,0.38937664,0.24175449,0.36810958,-0.42759034,0.15830807,0.23981921,0.4969648,-0.53929,0.555955,0.28331622,0.104430616,-0.07215799,-0.47979268,-0.01883684,-0.71203053,0.020593354,-0.0297787,0.035844285,-0.39542124,0.85967344,-0.027420403,-0.43665585,0.303914,0.4038743,0.41077954,0.999476,-0.04496488,0.6133481,-0.33190814,-0.14294288,0.4628955,0.44224325,0.5094765,0.08124497,0.44696495,0.99898475,-0.3719558,-0.27752337,-0.55761915,0.61233807,0.9999061,-0.99360377,0.077635184,-0.14057778,-0.04492611,-0.72035754,0.528841,0.13873206,-0.40037766,-0.81552064,0.9833374,-0.16581796,0.5255895,0.21191305,0.28770298,0.26014516,0.45973855,0.11187342,0.93696433,0.05605394,0.08672647,-0.1964036,-0.96736735,-0.10556819,-0.4841005,0.41683313,0.4688333,-0.76277643,-0.42237574,0.118839845,0.57829237,-0.94735473,-0.046605878,-0.12874876,0.30684918,-0.17020501,-0.28951928,-0.3557522,-0.19253872,0.7636177,-0.23762701,-0.17497323,0.4290176,0.43411675,0.25232354,0.45606425,0.5618713,0.5091248,0.575039,0.481238,-0.098750524,-0.12760538,-0.39702025,0.8927642,-0.99654657,0.2532967,-0.45831645,-0.3298965,0.3782712,0.34571642,0.38306314,0.99886936,-0.31571716,-0.28387552,-0.27366495,0.2861037,0.40519726,0.26771396,-0.58748686,-0.41998193,-0.12640624,-0.63133216,-0.2922191,-0.06245164,-0.5698807,0.048296742,-0.09953937,0.9077833,0.098508656,0.99392796,0.004292909,0.45935142,0.2888283,-0.22671497,-0.5673353,0.10016921,0.32028383,-0.562747,0.2454231,-0.46926537,0.1295629,0.12540427,-0.43528575,-0.8331748,-0.13527437,-0.20304325,-0.40635723,0.5081303,0.52208316,0.608239,-0.48971018,0.31478053,0.34268785,-0.13930288,-0.95385987,-0.4640645,-0.11825011,0.001412075,0.20441599,-0.47751454,-0.29661092,-0.6636316,-0.10505405,0.16111504,0.40189603,0.2804441,-0.26897097,-0.47686476,0.16305362,-0.25448996,0.99983317,0.44510925,-0.5603958,-0.13070245,0.99723774,-0.20395586,-0.5550413,-0.9983511,0.45465386,0.016845748,-0.21906632,-0.07632213,-0.320615,0.15045656,0.5367476,-0.6552046,-0.14371045,-0.4950374,0.36365923,-0.3512868,0.34481823,0.31953886,-0.9999211,0.9958411,-0.97925,-0.1969963,-0.15818869,-0.023982868,-0.2452881,-0.26123977,0.49190784,0.37222064,-0.23876144,-0.47426286,-0.034451976,-0.23035027,0.300066,-0.6506058,0.35335413,0.6739597,-0.4767252,-0.96976626,-0.9998389,-0.43088406,-0.33212262,0.26977175,0.32349858,0.1480457,-0.99685264,-0.69761235,-0.6997355,-0.10150787,0.052940253,-0.40987882,0.4344657,0.2629556,0.17114894,0.8187403,0.23966646,0.62388563,-0.49847448,-0.7335795,-0.08284516,0.25536063,-0.36809513,-0.46292195,0.11954421,0.25600722,-0.47591802,0.43625376,0.16276202,-0.64945215,0.23557986,-0.981457,-0.5140933,0.10398093,-0.26883867,-0.6444821,0.37409493,-0.53545195,0.2999949,0.16661762,0.14619647,0.99971294,0.3603189,-0.4845657,0.5069779,0.06671256,-0.16009088,-0.3610652,-0.3698546,-0.014123237,0.06931652,-0.63051474,0.6110137,-0.012130058],
    [17,1,"CCCCC(CC)Cn1c(O)c2c(c1O)C1C=CC2C1",-0.11247438,0.33258653,-0.004536043,-0.21576996,0.26911637,0.5509179,-0.44714203,0.3499049,0.15462373,-0.20863247,-0.89691794,-0.5581372,0.52766824,-0.5394125,-0.1670511,0.07097205,0.1985949,-0.25461343,0.63609654,-0.43038887,-0.6017842,-0.28489143,0.7149883,0.008707299,-0.77473104,0.60764015,-0.09979751,-0.74465936,0.7724161,0.002412018,0.61609083,0.681497,0.39080274,-0.45534125,-0.067161605,-0.45995125,-0.07049825,-0.48301557,0.9971152,-0.5328054,-0.54611,-0.27615988,-0.65196365,0.05999038,-0.10622939,-0.7498199,0.042470578,-0.6534284,0.7548841,0.06811923,0.6155518,0.112906165,-0.3035962,0.19741493,-0.7798437,0.63039744,-0.13474952,0.15524863,0.65302545,0.06578215,0.23469241,-0.51652396,-0.490514,0.05771838,-0.405717,0.48628736,-0.7405345,0.16808315,-0.48446748,-0.42465618,-0.64027315,-0.55397606,-0.10788731,-0.2402707,0.61893725,-0.68391114,0.16102706,0.18366048,-0.93828946,-0.99819857,-0.7265784,0.6491031,-0.87547773,0.57795,0.69507235,-0.9349991,-0.6345001,-0.43695495,-0.28270218,0.7470167,0.38019416,0.48428902,0.114086814,0.6365343,0.8740005,0.032793086,0.63377935,0.02826173,-0.59938055,-0.3061674,0.25163773,0.28106335,0.5172391,0.7275613,-0.9803889,0.42433903,-0.21084319,0.73038036,-0.99985254,0.12852415,0.3049655,-0.09634148,0.81735337,-0.04530594,0.05420796,0.5393502,0.001524853,0.18010099,0.9932573,0.19456059,-0.04930768,0.5413788,-0.6922782,-0.60531425,-0.774165,0.6351978,0.5105514,0.33825868,0.8232866,0.9998977,0.15217327,0.6250381,-0.63123935,0.56087756,-0.36905664,-0.75666714,-0.09907262,0.70706445,0.4576266,-0.658049,-0.9999917,0.320366,0.9426103,0.66146845,0.009207837,-0.4929919,0.112490274,0.14019564,-0.6650753,-0.3191196,-0.46810734,-0.8056168,0.84558755,-0.22663605,-0.04420663,-0.54204196,0.5027366,0.6513757,-0.7649549,0.01161589,-0.9161832,-0.56387925,0.37367868,0.45535502,0.4984311,-0.39825648,0.29339632,-0.7781699,0.5320117,0.77553016,0.1535651,0.7640109,0.39111283,0.5490537,-0.39608625,0.05313152,0.2918394,0.022312857,0.51557225,0.11886747,0.69725287,0.027243314,0.42177835,0.7545697,0.38868123,-0.092040434,-0.04547349,0.61666465,-0.6853266,0.6129658,0.23732497,0.4163826,0.31999964,0.43561393,0.007704403,-0.17877084,-0.06433129,0.2785639,0.22108018,0.52535826,0.45809826,-0.066573806,0.7302971,-0.2671586,-0.05763847,-0.8600849,0.010812044,-0.13032678,-0.09766337,-0.9998256,-0.35226545,0.12205537,0.14218204,-0.5810206,0.49718076,0.5003663,0.23053029,-0.3424369,0.12031306,0.21526346,0.031229086,-0.12528689,0.002247415,0.046953097,0.99998146,0.7587397,0.48126262,0.5713654,0.051598758,-0.36924303,-0.5488897,0.27116403,0.56958383,-0.13725206,-0.10560661,0.24470459,0.13619375,-0.36057976,-0.020365048,-0.2255499,0.8941404,0.36643913,0.24060136,-0.44707784,-0.66484714,-0.5006443,0.42942494,0.0479573,-0.31508625,0.68116987,-0.3145552,-0.67156184,0.44192317,0.41743544,-0.58580303,-0.81719106,-0.45361918,-0.37961572,-0.05769499,0.9301048,-0.1088577,-0.4038001,-0.13379417,-0.64305824,0.38232046,-0.36736467,-0.3423715,-0.011876042,-0.6274492,-0.29163644,0.2975108,0.9990523,-0.17458393,0.30900037,-0.010810289,-0.62565064,0.003897297,0.1631404,0.71373105,0.10760432,0.426375,0.99855345,0.06181976,0.2748849,-0.6196406,-0.02470446,0.1091507,0.36249086,-0.5559278,0.66165185,-0.17097612,0.973988,-0.4998635,0.74065334,-0.8403445,-0.41569334,0.9999964,-0.9941772,0.06566242,-0.115948826,-0.5697415,0.29369792,0.48157918,0.48637512,0.45745897,-0.96898764,-0.60840356,0.5422662,-0.18492971,-0.39977717,0.33726016,0.4455554,0.38575664,-0.07431176,0.82484215,-0.67761904,0.12856543,-0.21358927,0.98563427,0.06680812,0.5806008,0.54031307,0.7342701,-0.7905904,-0.34310457,-0.8075903,-0.4499413,-0.84830433,0.6239372,-0.45277187,0.34834722,-0.11404427,-0.30779403,0.7081134,-0.5133315,0.77420396,0.6421424,-0.85976756,0.6494091,-0.67244995,-0.6328087,0.6314397,0.6115991,-0.5156498,0.20598648,-0.5157901,-0.3613209,0.6950168,-0.010027029,-0.5008023,-0.96563166,-0.47432363,0.19069812,0.7226189,0.5233643,-0.12692769,0.492405,0.9998941,0.39226946,0.57754767,0.018594,-0.6523071,-0.18828642,0.3502019,-0.8233284,-0.8093224,0.2419701,0.37663722,-0.0353995,-0.08227457,0.46515802,-0.6644464,0.1577185,-0.68523586,-0.22040506,-0.9963616,-0.23842028,-0.36588606,-0.6237628,-0.19373435,-0.52936625,0.39967868,-0.4877631,-0.18656455,0.5266464,-0.7711324,0.018178256,0.16803251,0.2550705,-0.38075367,-0.5868049,0.48574203,0.15856339,0.12622802,0.002748814,-0.4129454,-0.5540988,-0.90050095,0.07156279,-0.6499832,-0.49796146,0.008417411,-0.62937564,0.7463571,-0.21409611,0.36509886,0.41083318,-0.9099435,-0.4481441,0.54093665,0.12277204,-0.52191806,-0.27126515,-0.7348516,0.62501806,0.6702615,0.8223171,0.18028134,-0.9851701,-0.3137685,0.9989516,-0.4640639,-0.25359082,-0.9941309,-0.8363365,-0.21054703,0.3727212,-0.7174717,0.39917326,0.5754974,0.28808257,-0.9310181,0.29334012,-0.09608215,-0.35394493,-0.011560157,-0.051571995,0.20825858,-0.99996996,0.99999964,-0.75567085,0.6251504,0.893482,0.52871466,0.021037411,-0.6162039,0.27488872,-0.85655355,-0.11686772,-0.003934924,-0.543137,-0.5362414,-0.77439725,0.54460704,-0.41476408,0.09542425,-0.5209993,0.002003257,-0.9998741,-0.5516166,-0.21857056,-0.6207305,0.62871265,-0.22695011,-0.9526468,0.3274626,-0.6609626,-0.7149754,-0.012573518,-0.4389096,-0.3115088,0.8421332,-0.57080203,-0.53283405,0.84458125,0.6540257,-0.30603856,-0.83151865,-0.39550936,-0.34027728,-0.53064567,-0.60912097,-0.97973615,0.7057651,0.062062413,-0.6829719,0.86036354,-0.26456618,0.4193522,-0.58876264,-0.48972574,0.15900017,-0.53355277,0.97271,-0.70542485,0.047466587,-0.13117537,0.36612004,0.42144892,0.9999395,-0.23678431,-0.7962012,-0.35513362,0.11118353,0.36306906,-0.043742873,-0.9957996,-0.6480296,0.4490684,0.21774645,0.15701717,0.3366022],
    [18,1,"CCCCOP(=O)(OCCCC)OCCCC",0.94835097,-0.17416036,-0.42454907,-0.095592864,0.38720655,0.5603773,-0.9770716,0.14426331,-0.17002511,0.81388575,-0.76453954,0.44775975,-0.5380853,0.055888526,0.045264922,-0.6712727,0.49951097,-0.21512583,0.023936886,-0.51302093,0.7467978,0.07259347,-0.2819768,0.5335694,-0.1518078,0.117717996,-0.19013554,-0.49147522,0.64416575,-0.43009916,0.14288898,-0.25644284,-0.33742368,-0.042771254,0.81264126,-0.6188706,0.08716271,-0.1581598,0.96420443,-0.6199212,-0.89784455,-0.41298983,0.1575496,0.5398111,-0.2997427,-0.94124067,-0.5593338,0.1260032,0.99903977,0.18900469,0.67685103,-0.10553519,-0.1586829,0.4492231,-0.70626503,0.14476752,0.93331265,0.80608356,0.594628,0.47316703,-0.081297256,0.699763,-0.020137893,-0.010830578,-0.19157541,0.6612194,-0.48004627,-0.39976114,0.13600872,-0.6061295,0.7622213,-0.61824304,0.015886696,0.87899125,0.61971396,-0.5799616,0.40551046,-0.28020558,-0.14363216,-0.9996376,0.6799222,0.330173,-0.4735226,0.031392634,0.59979755,-0.7103921,0.34465185,0.71767414,0.7389278,-0.09518603,0.5297782,-0.21615466,0.4254702,-0.11372609,0.9956837,-0.24694549,0.34217507,-0.040789906,0.32592455,-0.002396217,-0.18878846,-0.45078665,0.23828755,-0.28473437,-0.4157832,-0.8969143,0.44086894,-0.27300483,0.997346,0.2248553,-0.19677092,-0.6865643,-0.2501711,0.112765394,0.20029384,0.45094007,-0.5201262,0.69083625,0.99710417,-0.029892262,0.13048625,0.38533017,0.5384072,-0.47643957,-0.26227182,0.55902517,0.60568666,-0.8849698,-0.1225496,0.99983567,0.40306932,-0.29284135,0.14197513,-0.29124463,0.19949497,-0.97373754,-0.15883759,-0.5951562,-0.1258863,-0.20140739,0.9995201,0.17455359,0.93534505,-0.7048919,0.003850672,0.45392552,0.019706482,-0.04082408,0.47714394,0.45942196,-0.17137267,-0.88798976,0.6354358,-0.22940242,0.11717617,0.14852412,-0.6113751,0.9805769,-0.89138067,-0.973389,-0.9367155,-0.8378819,-0.26312467,0.27603194,-0.07917221,-0.14899501,-0.46874985,-0.046570145,0.35015923,-0.5477233,0.19354014,0.12832981,0.5028678,-0.26929936,-0.008697771,-0.8922712,-0.50757265,0.7809313,-0.7743283,-0.55416715,0.8120269,-0.9407315,0.7117788,0.04145443,-0.67588824,-0.49216822,0.62439555,0.00364625,-0.21378647,0.4350977,-0.27207434,-0.3264042,-0.36128196,0.05110465,0.303202,-0.09155185,0.416255,-0.8280067,0.17676367,0.4966793,-0.4723965,-0.7052999,0.1735511,0.44154036,-0.6033634,-0.42874953,0.102926806,-0.55225897,0.26878273,-0.999389,-0.14501299,0.17741796,0.4685268,-0.34356433,-0.07696782,-0.26453003,-0.79903924,0.18076044,-0.17148505,-0.029813446,0.36838967,0.23052627,-0.11407297,0.086848475,-0.99214077,-0.19664805,0.64640826,-0.3166226,-0.10348696,0.025425702,-0.66219026,-0.29840085,0.41822538,-0.23645277,0.36804235,0.33834502,-0.026036026,-0.058728043,0.72892433,0.46514726,0.83403724,-0.25859696,0.09962906,-0.63637495,-0.741067,-0.45297715,-0.19781366,-0.5924853,-0.4832015,0.2972989,0.6493469,-0.99980104,-0.021907222,0.66573435,-0.061929874,-0.48009244,0.25892535,0.28178787,-0.37655932,-0.17713453,-0.31374845,0.6129243,0.55069816,-0.018520094,-0.4363552,0.012336555,-0.47120726,0.12226405,0.83921474,-0.5085915,0.58175087,0.9476945,-0.56654865,0.032440882,0.06807348,-0.9438494,0.33836997,0.39553103,-0.15322606,0.832768,-0.57976395,0.99753845,-0.5963562,-0.23946795,-0.78398293,0.1925195,0.6326701,0.8476101,0.849535,-0.6179524,0.5332777,0.9964023,0.1271119,0.928297,0.31204703,-0.13223498,-0.9984604,-0.99155295,0.14080825,0.16422564,-0.7537704,0.4440043,-0.3257696,0.0727249,-0.18200655,-0.57398933,0.84857726,-0.11481196,0.4070232,0.49045196,0.62097263,0.6126853,-0.16395102,0.24550866,-0.044587195,0.1382253,0.22497693,-0.7487473,-0.9999856,-0.5479405,-0.39947605,0.55256134,-0.09856372,-0.9585485,0.72609186,-0.52789026,-0.28332353,-0.8420201,0.22147425,0.25584677,0.4810647,0.08616349,0.016120385,-0.2652255,0.09287708,0.82859474,0.5794913,0.1594736,0.8638619,-0.04679702,-0.3037567,0.13570507,-0.37341467,0.7999849,0.76198834,-0.5666122,0.03914553,0.6661728,0.33757505,0.5247476,-0.9830039,0.14487444,0.5867298,-0.15864052,0.057795223,0.29084182,0.18485387,0.99986774,0.08750352,0.43024144,-0.23361678,-0.56897247,0.22106113,-0.21467327,-0.43678865,0.10667398,-0.8599478,-0.02777747,0.18219599,0.6254911,-0.042917013,0.07839953,-0.119667485,0.47104582,-0.15435536,1,-0.3200277,0.18122774,-0.31287476,0.6731095,-0.19215608,0.20661847,-0.48907003,-0.018027991,0.7018454,0.011381998,0.004669428,-0.00022031,-0.57024544,0.27694008,-0.20232385,0.2648539,0.03798031,-0.6109825,0.4779772,-0.959944,0.54147464,-0.54306316,0.26662374,0.037352774,-0.24699998,0.08896184,0.33860767,0.3320708,-0.11520785,-0.4723059,0.6980836,0.4378508,-0.01035218,0.11412504,-0.7327409,0.60865784,-0.06634641,0.29890922,0.060465034,-0.4610309,1,-0.3471848,-0.77868587,-0.531097,0.9977947,-0.109996155,0.000312632,-0.9999709,-0.57875913,-0.933884,-0.049312428,-0.3342135,0.35914034,0.53781873,0.35571972,-0.608705,0.067307964,0.7091468,-0.23593083,0.19616143,-0.3175514,0.13305561,-0.99972486,-0.9999999,-0.9845393,0.49660683,0.10285858,-0.62861896,-0.18022598,0.5201107,0.3839643,-0.59009206,0.42230594,0.5941338,-0.54613435,-0.029971449,0.048937254,-0.25842693,0.6607589,0.39907652,-0.08672683,-0.8833823,-0.9992679,0.47840974,-0.45649797,0.5712729,0.10677826,-0.5185133,-0.9098195,0.8003786,0.49334833,0.17102778,0.17942107,-0.8067433,-0.009002117,-0.7798355,0.64901614,-0.94198596,-0.048504997,0.44079477,-0.19333264,-0.28826526,-0.227104,0.02674385,-0.65287083,0.48055366,-0.99866605,0.22557276,-0.7018845,0.1586685,-0.20833354,-0.78585786,-0.092588946,-0.055595722,-0.5517552,0.64209497,-0.15884955,0.5819383,-0.6113362,-0.1209245,0.1575098,0.26473993,-0.24070297,0.9997861,0.44451368,-0.9096545,0.31386653,0.3270674,-0.10220071,-0.6454089,-0.9490637,-0.2060926,0.10382501,0.011804666,-0.08852713,0.08946993],
    [19,1,"CCN(CC)CCOc1ccc(C(=C(Cl)c2ccccc2)c2ccccc2)cc1",-0.50564516,0.37936184,0.47324416,0.31041682,0.024862576,-0.7593118,0.3463916,-0.36254817,0.63320315,-0.13297324,-0.7754497,-0.53285706,0.22310677,-0.8316997,0.32516137,0.3729815,0.14777632,0.35337043,-0.031285774,0.44159216,-0.02249697,-0.030745242,0.595272,-0.788499,0.33842105,0.48671526,-0.50368094,0.16947842,0.20530878,-0.8255928,0.7911248,-0.5208664,-0.44370833,-0.13298568,-0.3665668,0.1286906,-0.60846734,0.914296,0.9997096,-0.8524645,-0.7943953,0.07245878,0.3628575,-0.29127884,0.026668197,0.6375503,-0.4495898,0.3881607,0.999014,-0.31316754,0.3879668,-0.3418699,0.49903873,0.18725947,-0.8497781,0.06385909,0.05688635,-0.78677946,0.17755628,0.3975741,0.21164554,-0.45076677,0.26586056,-0.28736255,-0.33566228,0.028397568,-0.20949744,0.262111,-0.2057237,-0.33950767,0.40351525,0.8130864,0.8459092,-0.25857833,0.89675057,-0.55807126,-0.22904982,-0.005800462,-0.2796999,-0.99558544,0.515511,0.72458655,-0.9105835,-0.0963882,0.8024943,-0.988908,-0.39033753,0.058018014,-0.73881173,0.5539242,0.70433265,-0.42890194,0.07493261,-0.4308912,0.7883222,-0.18866064,0.87702894,0.65174484,-0.4334928,-0.72504103,0.32223457,0.1613216,-0.5367563,0.97796404,-0.9995756,0.33324817,0.017974552,0.5965614,0.9738284,-0.45636982,0.75273085,0.09263284,0.50714546,-0.42292655,-0.63021266,0.65678245,-0.06457782,0.80345,0.80712,0.4961865,0.480041,0.2476653,0.08846733,-0.23723927,-0.16921927,0.4484206,-0.23678048,-0.10354317,-0.26185775,0.99999404,0.29194492,0.7472968,-0.28906167,-0.522558,0.1982778,-0.9924994,0.66553795,0.5930083,-0.56595546,-0.5461803,-0.99999756,0.31064346,0.9511604,-0.27102607,0.36060998,-0.3044187,-0.57177216,-0.15029989,-0.9979793,-0.28045365,0.088809974,-0.8630786,0.4190362,0.31521037,-0.15417789,0.12631986,0.59403604,-0.90148824,-0.8797045,-0.9547628,0.12605934,0.64203733,0.19446924,0.70555335,0.6533877,-0.6697973,0.4616395,0.25327247,-0.48121876,0.15033439,0.1828378,0.036734328,0.45944244,0.51629627,-0.34296238,-0.9144827,-0.54066354,0.15464918,-0.04996526,-0.42990837,0.45742553,0.85931927,-0.07142711,0.34397385,0.3495803,-0.21807559,-0.6381836,-0.06878841,0.005752714,0.6533147,-0.838736,0.25799844,-0.3097601,-0.18020834,0.21771975,0.029398117,-0.20402686,-0.8849035,0.91674834,0.53045964,0.3991399,-0.565394,0.5358554,-0.091317594,0.47212833,-0.62444806,0.15399875,-0.8686735,-0.17947313,-0.9999645,0.7013808,0.2966016,0.46964273,0.27625823,0.080795586,0.019324604,-0.15261434,0.6333041,0.63640904,-0.12866107,-0.1339585,0.47257388,-0.8628093,-0.5125354,-0.9902324,0.031924885,0.7057658,0.044108603,0.32614645,-0.48328942,-0.007231209,0.43784052,0.16661243,0.7276825,0.67566186,0.047493704,0.5748546,-0.30275103,-0.15787217,0.14317875,0.7823302,-0.21076961,0.38657287,-0.13898648,0.18277533,-0.71553355,-0.39145714,-0.6598647,0.1277852,-0.004949635,-0.21865745,-0.7648027,0.10384611,0.014930128,0.6007489,0.43376532,-0.41001216,-0.471231,0.41068518,-0.061637945,0.1387031,-0.58315516,-0.5228043,-0.43804651,-0.042256713,-0.5112331,-0.62237066,-0.13531558,0.9788313,0.7808768,-0.46743292,0.9981489,0.07440889,-0.19912066,-0.580587,-0.6939306,0.35163882,-0.6406984,-0.5211673,0.30997992,-0.43130443,0.98181736,-0.72444266,-0.646144,-0.06812144,0.15382925,0.057598077,0.9861092,0.8357473,-0.4835018,-0.10171038,-0.03678635,-0.22116031,0.53277,-0.2035135,-0.814206,0.99999565,-0.9997064,0.033773568,0.1507543,-0.09671988,-0.8219011,-0.4336111,-0.22133504,-0.4847382,-0.9353453,-0.99705523,0.3418726,0.9581189,-0.73518974,-0.59075546,0.51485866,0.26965877,-0.015831782,0.9544585,-0.77432686,0.32438022,0.16460848,-0.99996436,0.47924146,-0.53588873,0.110191934,0.10756333,-0.7326747,-0.59805083,-0.84324205,0.5244027,-0.971927,0.6870979,0.2972004,-0.5689549,-0.1341715,-0.17814349,0.09896202,0.001505677,0.9926425,-0.24417515,-0.32054624,-0.36353022,0.09590129,-0.11913899,-0.25556317,-0.027686331,0.29294443,0.54865825,-0.45811397,-0.071112126,0.7466804,-0.15841278,-0.93194413,-0.7857646,0.3479304,-0.37954384,0.44340166,0.68990797,-0.5884844,-0.250191,0.9998188,0.41083777,-0.050467093,0.38131288,-0.3274702,-0.4808054,0.009192144,-0.982788,-0.5278156,-0.48796794,-0.76149976,-0.47748357,0.3417265,-0.31837526,0.5392695,0.02636416,-0.44362935,0.75503445,-0.9837005,0.3426746,-0.32357928,-0.27994582,0.019276632,0.2180986,0.25688604,0.10902005,-0.24383457,0.17572986,-0.44346002,-0.14423533,0.50279355,0.264396,0.29501617,-0.15100408,-0.23695612,-0.2605282,-0.000827187,0.3057468,-0.43541217,-0.7592019,-0.96989167,-0.38789144,-0.94103926,-0.6120963,0.5301056,-0.18597536,-0.43397105,0.3174235,-0.51397413,-0.63502675,-0.8998389,0.1255944,0.44186208,0.38175908,0.4415906,0.2141391,-0.21862085,-0.38396606,0.3444518,0.99999976,0.5587816,-0.90570855,0.21522968,0.999157,-0.24480638,-0.76441085,-0.9999532,0.4433475,-0.85416865,0.05347704,-0.048403423,0.51579237,0.6035017,0.19669378,-0.898959,-0.45497394,-0.13401072,-0.13691929,-0.2062158,0.89815205,-0.27576098,-0.99992365,0.9999991,0.70635676,0.06931615,0.38259763,-0.86012065,-0.26524976,-0.857695,0.15223016,0.4579891,0.061849777,-0.43325055,-0.84981763,0.19658995,0.73065835,0.03614062,0.14699085,0.13753432,-0.60724163,0.98139876,-0.9983574,0.58972627,0.5712734,0.024563259,0.057653632,0.3919615,-0.99743396,-0.3821099,-0.20527542,-0.6155892,-0.6214579,0.13268052,0.3311292,0.9749754,-0.26216283,-0.23273286,0.8880918,0.5868985,-0.19565792,-0.6786826,-0.4820774,0.5153324,0.081993975,-0.9343469,-0.9722255,0.32626215,0.7853991,-0.57015485,0.26120898,-0.1336767,0.45261967,0.6384671,0.1894304,-0.41255662,-0.8258442,0.9994963,0.84760404,-0.46030283,0.47670254,0.3372958,0.29559258,0.9993869,0.8094187,0.000318535,0.3484703,-0.15548024,-0.43248358,0.46917507,-0.99800235,0.47622228,0.75057554,0.5229919,0.36860895,-0.45053956],
    [20,0,"CCOCN(C(=O)CCl)c1c(C)cccc1CC",-0.8438642,0.08494755,0.09611071,-0.5249675,0.5498055,0.66824615,0.06535262,-0.037665255,0.1059342,0.21071818,-0.60092336,-0.03716665,0.23449092,-0.0472824,0.37177038,-0.48725492,0.33317804,0.10175576,0.8156163,0.13267305,0.1550972,-0.26689252,-0.3617917,0.43550813,0.35244185,0.026497753,0.3178839,0.116732635,-0.2015707,0.014827805,0.1526431,-0.5642902,-0.61980766,-0.48459858,-0.47834718,-0.14015889,0.5398597,0.32645273,0.97927016,-0.6832287,-0.9550963,-0.17269655,-0.30942735,0.32882744,-0.18487854,-0.96537364,-0.32263216,0.44913802,0.9910732,0.6083926,-0.34619457,-0.6649544,0.02853986,-0.056047786,-0.84782284,0.23763931,-0.16649564,0.6065746,-0.1524229,-0.06226217,0.296184,0.67348796,0.09828785,-0.03366742,-0.5558496,0.52991134,-0.38060135,-0.2628605,0.36963442,-0.402274,-0.6459889,-0.9593977,0.54811776,0.010738742,0.8018875,-0.37299463,0.040075332,-0.2169261,-0.36722916,-0.9995042,0.09887116,-0.0800953,-0.9094785,0.10956107,0.22830893,-0.43414524,0.7014208,-0.26087594,-0.17573212,0.5102146,0.27249902,-0.19852053,-0.17209418,0.13640837,0.9836311,0.13145657,0.36066124,0.2723629,0.7253322,0.041510474,-0.71918035,0.19874495,-0.5870606,-0.35803843,-0.61241674,-0.0654944,0.17663768,-0.11663857,0.9656765,-0.575426,0.31937617,0.6398911,-0.30119947,0.27728048,-0.56050074,0.5915622,-0.075698115,0.5965776,0.99863786,-0.59589624,-0.005640845,-0.100247435,0.32419658,-0.52231604,0.17005815,0.43975887,0.5920592,-0.2809202,-0.22475673,0.9995228,0.51883656,0.40269828,0.13583589,-0.35784537,0.30359435,-0.9797051,0.7449221,-0.24937698,-0.71783894,-0.9019979,-0.9973643,0.15659416,0.9789105,-0.1929562,-0.1777478,0.2456095,0.077527925,-0.22637936,0.48610923,0.30309695,-0.37243024,-0.3704359,0.356163,0.084438056,-0.24888901,0.44817153,-0.14254297,0.9645973,-0.8285276,-0.95410293,-0.9557752,0.17021525,-0.35416418,0.056561362,0.28400046,0.7960375,0.39049822,-0.19613503,-0.4130271,0.63005227,-0.1506987,-0.3129698,-0.4903084,0.24535778,-0.5477341,-0.90624624,-0.5641976,0.2531581,0.23110169,0.21878979,0.5635481,-0.3955027,-0.4424516,-0.6852604,-0.2218816,-0.6656447,-0.8211839,0.023956288,0.18099208,-0.6310987,-0.33266255,-0.79427165,0.68028724,0.5551411,-0.57187545,0.20847128,-0.36395052,-0.8135928,0.22666207,0.13378122,0.53200996,0.10917947,0.112636834,-0.82452047,0.31369802,0.2375947,-0.38090682,-0.16850552,-0.2619704,-0.9994209,-0.44388124,-0.48423055,0.3144124,-0.15355264,-0.005782249,-0.45933327,-0.3779077,-0.71439254,-0.17553727,-0.3169302,0.3780192,-0.023609452,-0.6725191,0.19379556,-0.9908069,-0.39698014,0.23685664,-0.1753405,-0.1450356,0.11176157,0.41423017,0.30830976,0.40344322,-0.5582699,0.23933789,-0.43417314,-0.17702495,-0.25741407,-0.6293997,-0.6413714,0.7204703,-0.18217613,-0.19708012,-0.14656846,-0.01731574,-0.45289552,0.17790142,-0.58953613,-0.44563735,-0.19186488,0.5807538,-0.9983419,0.03349124,0.4886918,0.46437064,0.035322633,0.6468065,0.062335934,-0.2736314,0.5282695,-0.096585475,-0.6092003,-0.043143373,0.058383618,0.029071402,0.26590326,-0.71344024,0.05295906,0.9712755,-0.37662902,0.6859487,0.99483544,0.020764578,0.10436173,0.29383695,-0.88284284,0.06031378,-0.5213602,-0.9108858,0.44937646,-0.014154269,0.9986699,-0.04189745,-0.6693138,-0.3788652,0.032846197,0.19087413,0.7963007,0.93158984,0.5404872,0.49934658,0.99535793,-0.09018684,0.94571626,0.12788369,-0.8815438,0.9965085,-0.97864896,0.08429495,-0.25516927,0.45518428,0.34025326,-0.0489583,-0.4757463,-0.39417282,-0.624138,0.46790612,0.051084865,0.1895922,0.037868038,-0.6078071,-0.58728653,0.23021387,-0.2162861,0.44639322,-0.48172617,0.31065223,-0.4758386,-0.99992687,-0.5242904,-0.5644182,0.22905765,-0.19250424,-0.5196762,0.3308157,-0.2773846,0.28908306,-0.8176666,0.11041844,0.018321171,-0.14101481,0.525945,-0.5536378,0.242206,-0.29060236,0.179763,0.11699411,0.27084556,-0.19458859,0.14593834,0.085361615,-0.25257802,0.6664336,0.20234948,-0.09628204,-0.6106118,-0.31446356,0.48067862,-0.24184096,0.40840843,-0.98432493,-0.13403596,0.6978656,0.12897424,0.4405322,0.33274618,-0.8031688,0.9997687,-0.38695523,-0.34839952,-0.21173312,0.03145582,-0.43900436,0.06905607,-0.8570634,0.4643677,0.6989574,0.16272637,0.2550699,-0.6438415,0.17249855,-0.12184723,-0.012935489,0.5524348,0.5965591,1,-0.5237844,0.40611002,0.51726526,0.5291552,-0.5388434,0.88756824,-0.31787163,0.30509153,0.34707367,-0.4962931,-0.24070673,0.09877606,0.0901192,0.19768353,-0.0967407,0.29556248,-0.12607476,-0.093086824,0.18376578,-0.9246056,0.4099648,-0.77984357,0.82614285,-0.38184652,-0.6649373,0.471264,0.28954443,-0.35284078,0.40653953,-0.40559375,-0.16200835,-0.7108268,0.67247766,-0.22146152,0.053423595,0.36526558,0.39060342,0.32631102,-0.41448617,-0.07955922,0.9999999,-0.44821367,-0.9507812,0.46601894,0.9996618,-0.2994932,-0.60134614,-0.999919,0.08315254,0.04742445,0.50028366,-0.1799456,0.527851,0.29544976,0.7286224,-0.193455,0.33749694,-0.24669895,-0.16484123,0.56317794,0.67805934,0.15680458,-0.9999535,-0.9988765,-0.9662583,0.2948044,0.38399908,-0.7837074,-0.51229095,-0.5353308,-0.82159674,-0.35835925,-0.15360044,0.24022281,-0.62355447,0.26972955,-0.2022764,-0.3576408,-0.042955354,0.26680484,-0.3790012,-0.6936534,-0.9998303,-0.602319,0.5864547,-0.00635002,0.38200226,0.24956147,-0.97098976,-0.43492475,0.40493616,-0.30930468,-0.522595,-0.060706157,0.49782407,0.9747182,-0.11262768,0.20121501,-0.45992318,0.7942301,-0.4875261,-0.035892747,-0.6249892,0.49554944,0.038757116,-0.65729964,-0.26231846,-0.02811667,-0.5719463,-0.07828451,0.33290082,-0.37493977,0.21662606,0.7236233,0.39669853,-0.31231186,-0.29779658,0.88727903,-0.53189594,0.42102784,0.43872404,-0.6616295,0.3339272,0.99964833,0.2387723,-0.1976078,-0.25737104,-0.15510751,-0.15684088,0.414452,-0.9529457,-0.14916576,0.488165,0.30522752,0.3419017,0.6106629],
    [21,1,"CC(C)=CC1C(C(=O)OCn2c(O)c3c(c2O)CCC=C3)C1(C)C",0.46101615,-0.2089213,-0.24726847,0.16711609,0.4369618,-0.014166684,-0.03764097,0.18161657,-0.19315027,-0.18238534,0.0651706,-0.70434654,0.75997,0.7011626,0.24298409,-0.2121061,0.5499575,-0.9261584,0.65101373,-0.32299346,0.00850525,-0.41784418,0.7347222,-0.039892968,-0.10437521,0.54722965,0.46898136,-0.4882317,-0.08371009,0.3805667,-0.17232071,0.47723696,0.06621514,0.028718784,-0.051273584,0.016215751,0.0939986,-0.015590604,0.99958086,-0.18341756,-0.14836735,0.002885119,-0.07245817,-0.7087222,-0.6024601,0.20382576,-0.6579415,-0.56283534,0.9831773,0.44868585,0.68367743,0.8437038,-0.03809653,-0.07065007,-0.30483413,0.16259804,0.27679896,-0.81250554,0.39003855,0.14424315,0.54845315,-0.88917106,-0.034716878,0.06823553,-0.6351944,0.09047369,0.67563,-0.570868,-0.79273146,0.23115335,-0.7673187,-0.7978524,-0.7099126,0.007535188,0.64445555,-0.27339417,0.3808964,0.027801039,-0.65536386,-0.9996781,-0.9527556,0.18062761,-0.94904715,0.37770033,0.37391713,-0.8740639,0.24138245,-0.68882513,0.5384818,0.39371458,0.06922032,0.28201577,0.34722853,0.6747371,0.9978072,0.2921441,0.12952127,0.16910614,0.37649563,-0.034720697,-0.07267431,-0.41778767,-0.14443627,0.88455826,-0.9991175,-0.17282304,-0.71787184,0.38482106,-0.9994801,-0.24408248,-0.10078072,0.38333893,0.6003554,0.0575056,0.24686702,0.37926874,-0.74902046,-0.13166828,0.9595465,-0.29786298,-0.5549351,0.46953303,0.026441323,-0.26916647,-0.61145306,0.45154554,-0.10465229,-0.12421256,0.44475245,0.9992562,0.2281948,0.60285723,-0.37515828,0.5384009,-0.30567783,-0.75945216,-0.106275044,0.12495514,0.24730717,0.058217563,-0.9999887,0.56593937,0.6223066,0.35501412,-0.2676684,0.21243617,-0.055798694,0.5462592,-0.9937891,-0.7670492,-0.12498542,-0.5865795,0.8554659,0.13959698,-0.61043453,-0.32399765,0.38971314,-0.65722317,-0.9141778,-0.5113755,-0.5001709,0.7204874,0.2431129,0.5111888,-0.059030127,-0.22979824,0.7188605,-0.34440422,0.71393293,0.13164245,-0.15092799,0.59677464,0.30047792,0.15298055,-0.17197162,-0.3602142,0.7571822,0.51299983,0.48646328,-0.018650722,0.48536307,-0.82400286,0.67976516,0.36996958,0.7513406,-0.16891026,0.37478393,0.2522006,-0.37560806,0.047429066,0.005742225,0.82245356,0.66827005,-0.28252774,-0.5852937,-0.37590626,0.17299122,-0.20156969,-0.21399179,-0.46271685,-0.65868205,-0.2577564,0.43814832,0.22023815,-0.72152525,0.43428084,-0.2787993,0.059738893,0.6270399,-0.99985707,-0.7286482,-0.50124884,0.04705518,0.14173968,0.10175975,-0.48431575,0.714848,-0.113179624,-0.012272348,-0.16872732,-0.30955654,0.29612875,0.3013689,-0.88282734,0.9998232,0.39460105,0.6235686,0.40312788,0.1797329,-0.15410234,-0.56089395,0.10938481,0.38996097,0.6578592,-0.50525576,0.4967113,0.42963865,0.23804837,0.19945611,-0.3970486,0.9144216,0.013322666,0.27246854,-0.74191165,-0.6046682,-0.5225253,0.8772239,-0.46002015,-0.1782509,-0.61061317,-0.04540044,-0.7646194,-0.19324599,0.50010705,0.067542076,-0.79203427,-0.68350697,0.23591982,0.11718102,0.6637283,-0.32699528,0.3341802,0.22554906,-0.25992414,0.19827563,-0.19413033,-0.1348152,0.06523262,-0.012016266,0.16751628,0.76171196,0.9997569,0.5109584,-0.08136274,-0.73716575,-0.39494646,0.21606974,-0.3766876,0.2845411,-0.9105463,-0.077560514,0.9896004,0.06473037,0.283087,0.6771789,-0.50918883,0.14207032,0.019471502,-0.8530898,0.3407713,-0.5291676,0.69682777,0.080627285,0.25355524,-0.78620535,0.19765428,0.99999803,-0.9301916,0.16072802,0.17097127,0.5137441,0.10262097,0.14185326,-0.20548621,0.0245169,-0.7741382,-0.9813667,-0.22625968,0.27279308,-0.61776245,0.8889284,-0.6110037,-0.28755406,0.116393656,0.32156134,-0.7984579,0.8247861,0.24003215,0.93486947,-0.07340468,-0.49994275,0.5126107,0.27802196,-0.27079245,-0.005462157,0.5354118,-0.32750136,-0.6681158,0.6769765,0.48012385,0.07723061,0.053984594,0.21939914,0.5866573,0.008964654,0.28705245,0.5495965,-0.45296672,0.017362006,-0.21722624,0.28908777,0.07099008,0.5882243,-0.1766461,0.09431109,0.36709175,0.13308252,-0.5442003,0.16633426,-0.8614068,-0.7229429,-0.31314132,-0.114765644,0.15247607,0.4824135,-0.12147674,0.64786017,0.9993754,0.47694328,0.6458696,-0.4847233,-0.09959513,-0.3080362,0.46839124,-0.8481102,0.6916868,0.13044995,0.7296762,-0.38398537,-0.4683174,-0.57227594,-0.10912864,-0.18562359,-0.70903283,-0.16095114,-0.97937554,0.52156836,-0.572581,-0.46121505,-0.6777972,-0.45382345,0.1945741,-0.34498814,-0.42181143,0.4656983,-0.25969702,0.72575754,0.5223655,0.4219588,-0.16388504,0.6141882,-0.18698657,-0.1702813,-0.22027305,-0.18438078,-0.47532326,-0.42018518,-0.021682175,-0.4386164,-0.11221032,0.733282,-0.18893507,-0.19195792,0.09418502,-0.13903163,0.8542134,-0.42924577,-0.75970334,0.24617076,-0.2526227,-0.35664722,-0.4894374,-0.8202648,-0.3889448,-0.5085741,0.052210264,0.9023133,-0.41335472,-0.9838656,0.3487427,0.99873894,-0.7899474,-0.111338824,-0.9938024,0.38547835,-0.71585673,-0.24984324,-0.6429599,-0.4387467,0.6436201,0.18983224,-0.71897197,-0.21174,0.23643327,0.54579383,-0.20464909,0.22412446,-0.45012373,-0.9999048,0.999999,0.073917754,0.07062404,0.6563336,0.3384123,0.25986132,-0.24738885,-0.13499261,-0.50294304,0.08034243,0.14683485,-0.44997433,0.7749105,-0.7369671,0.050089158,0.4788352,0.5014845,-0.81966996,0.828115,-0.99939567,-0.26313394,0.50305426,-0.274985,0.23972839,0.69884026,-0.54931873,0.4138995,-0.5310287,-0.41301197,0.42566326,-0.5505913,0.2828976,0.86013186,-0.8101444,-0.08758011,0.56684494,0.056548603,0.07073749,-0.6428543,-0.65713304,-0.39844784,-0.7943816,-0.39500594,-0.9967178,0.4339541,-0.18748584,0.40505582,0.62677616,0.118265875,0.43291998,-0.66888034,-0.51998955,0.18262596,0.048268374,0.9978225,0.4174246,-0.067312546,0.12144979,-0.13708177,0.59629846,0.9999213,0.13480322,-0.6102812,0.03717374,0.13247292,0.40948433,-0.21359095,-0.9991325,-0.24793138,0.38680384,0.27935535,0.20559415,0.10330505],
    [22,1,"Cc1ccc(-c2c(Cl)nc(C#N)n2S(=O)(=O)N(C)C)cc1",-0.036251355,-0.18236908,-0.25759804,0.33145332,-0.617458,-0.14183325,0.060507923,-0.49458584,-0.6846808,0.09493266,-0.26417452,-0.88188213,0.5630988,0.054715805,0.8546777,-0.17934214,-0.60212386,0.23760302,-0.7625401,0.5504605,0.8979925,0.49456427,0.54262286,0.12515847,0.105143465,0.3527777,-0.086736426,-0.475572,-0.47747537,-0.58123237,0.30254078,-0.17471966,0.10442152,0.17690964,-0.16450551,0.78417754,-0.106851436,0.18901086,0.9977187,-0.21175258,-0.8390593,-0.048756815,0.026443554,0.13943104,0.67414045,-0.66872764,0.14183646,0.1389887,0.84747887,0.081801645,-0.34069756,0.1826247,-0.66624224,0.7407543,-0.53418654,-0.22603779,-0.65151817,-0.6134236,-0.59650284,0.52458566,0.52433944,0.55639964,-0.44076827,-0.37214562,-0.4634304,0.6490709,-0.14127316,-0.24905609,-0.2708565,0.5561031,-0.5943802,-0.9963513,0.33918503,-0.6825281,0.4802642,-0.08348094,0.63290775,-0.43339637,-0.38717473,-0.9998804,-0.10365991,-0.13531318,-0.93462086,-0.13388035,-0.82562625,-0.19728665,0.8676,0.4465971,0.08514839,-0.1702803,0.028410215,-0.7106252,0.4778811,-0.037661865,0.99956286,-0.048364893,-0.32409507,-0.060536053,0.6418147,0.011484937,-0.38943622,-0.5996905,-0.035348907,-0.15732394,-0.9845766,-0.9155151,-0.6791688,0.16398044,0.98906976,-0.38923264,0.5260588,0.35633168,-0.2981078,0.7743139,0.37328827,-0.19137993,0.59263265,-0.73280376,0.99741894,-0.6776322,-0.29576093,-0.266228,0.41872567,0.06433104,0.29254568,0.06283432,0.36694613,0.279837,-0.08697233,0.9932521,-0.8304434,0.42575368,0.16436237,-0.09748227,0.15370207,-0.9838444,0.14246298,-0.57466877,-0.6749837,-0.36061993,-0.99998784,-0.12234613,0.47817075,0.13365562,-0.5028663,0.52169454,0.11908374,-0.04911556,-0.6468314,-0.5747747,-0.40307868,-0.5903422,-0.24432407,0.10453742,0.27765363,0.067157425,0.28625333,0.5288817,-0.84851557,-0.94490916,-0.8879918,0.58844763,-0.73790795,0.35569894,0.47895005,-0.31263822,0.37090462,-0.1417879,-0.111282796,0.6533722,-0.7237654,-0.7079645,-0.30893022,-0.35725167,-0.37037072,0.17500283,-0.208974,-0.19574267,-0.38114592,0.22337297,-0.16529538,-0.99567443,-0.10503487,-0.07231858,0.16762322,0.001289924,0.42925182,0.18531038,0.45009628,-0.650391,0.7708541,0.26771942,-0.30258736,-0.36339384,0.04737762,0.7313533,0.14848574,-0.45777908,-0.62328124,-0.38639018,-0.366618,0.46066287,-0.14885038,-0.30454308,-0.5543144,0.8411154,-0.19179192,0.5033971,-0.22610426,-0.99962175,0.65536267,0.062139194,0.1567622,-0.057996802,0.3683804,-0.35001767,-0.5264367,0.38652226,-0.019539863,0.7989115,0.6247183,0.33813718,-0.3603571,-0.17682348,-0.9654856,0.8883029,-0.14205848,0.66786957,-0.31079066,-0.41199952,-0.64072466,-0.17909169,-0.21491185,0.005822231,-0.7897017,-0.7574624,-0.34819373,0.37246874,-0.016790614,-0.16926445,0.8436566,-0.344389,0.014847048,-0.12012219,-0.0686981,-0.5132895,-0.3066872,0.48893225,-0.05304105,0.12761018,0.50584435,-0.97768986,0.40062273,-0.18050782,-0.4664685,-0.5265813,0.59518534,0.42068577,-0.15963784,-0.13631704,-0.663274,0.5851912,0.101106495,-0.080495566,0.73705196,0.3966388,-0.26207286,-0.19315434,0.9853131,0.56330854,0.90805346,0.99079937,-0.5367746,-0.017772574,0.4337481,-0.6197492,-0.00560771,-0.44811714,-0.54490936,-0.4430149,0.43772393,0.9979404,-0.73135346,-0.4068947,0.2892975,0.45502627,-0.3995434,0.6337004,0.7883053,0.13774115,0.41367623,0.96863306,-0.24570733,0.94455343,0.6899871,-0.3879157,0.9999927,-0.7664802,0.3470768,0.15797223,0.14706804,-0.1682003,-0.6073006,0.5194093,0.43325529,0.426329,-0.7116369,-0.30333665,-0.105937436,-0.45349097,0.216556,0.31420842,0.5448668,0.29591113,-0.8694508,0.20941243,0.63566625,-0.55113524,-0.9999602,0.4132271,-0.16672926,-0.21364221,0.36753637,0.5319867,0.2825021,-0.79536456,0.07531932,-0.63653004,0.30610397,0.67539406,0.5153406,0.39887643,0.0627628,0.3577642,-0.071332745,-0.71722716,-0.5075665,0.6536164,-0.63256925,-0.10354858,-0.14418782,-0.78032047,0.5660889,-0.3590162,-0.23327276,0.03136505,-0.27299547,-0.008822234,-0.73661464,-0.6453755,-0.92953783,-0.30912924,-0.49208897,-0.7141893,-0.19880652,0.051965624,0.7361437,0.99978137,0.5015024,0.5264524,-0.5463161,0.11535564,-0.30643815,0.5200221,-0.12834619,-0.1673923,-0.3885701,0.48741087,-0.21686886,-0.41626114,0.17785789,-0.094292074,0.7157581,-0.55405724,-0.17210273,0.98828036,-0.5498994,-0.2992839,-0.000883672,0.4612808,-0.3878196,-0.13716628,-0.69927096,-0.55377245,-0.16576377,0.49609643,0.5904274,0.017608197,0.19142649,0.5680877,0.43324634,0.3591568,0.18060964,0.21379049,-0.23166138,-0.65744674,-0.38777527,0.18213454,0.89952993,0.2868193,0.84791833,0.076528534,0.5711452,-0.5973433,-0.17217769,0.058785256,-0.20416908,0.020024676,0.02559349,-0.26154575,0.6714924,-0.31905743,-0.24358954,0.28700203,0.3177965,0.62280977,0.9999998,0.06970235,-0.9642871,0.78507954,0.9993001,-0.52023906,0.5143039,-0.99987864,-0.5887575,-0.2153135,0.71204966,-0.19807489,-0.48789507,0.5551649,-0.065355234,0.7685369,-0.32492617,-0.01079821,0.084450334,-0.7627776,-0.022999723,-0.35235667,-0.99999183,0.99886143,-0.89880013,0.4911672,-0.66979194,-0.8766719,0.3054514,0.5965818,-0.93174773,-0.5397288,-0.6721545,-0.62747204,-0.27848643,0.38629204,-0.6643242,-0.5599929,-0.04067734,-0.48668352,-0.26819378,0.093454026,-0.99994123,0.4265168,-0.4409679,-0.7737058,-0.4352904,0.29415777,0.087434314,0.67817813,-0.33486548,-0.14029953,0.016953735,-0.23585145,-0.5935351,0.9608192,-0.26396388,0.71235996,-0.7793486,-0.15807994,0.001775609,0.45058393,0.49936548,0.38854715,0.31043002,0.73456323,-0.6240833,0.59491754,0.14467278,-0.34896204,-0.42810732,0.4766626,0.12135578,0.50891554,0.3532194,0.17033426,0.23298621,0.9736348,-0.44519368,0.28467476,-0.27732828,0.08138925,0.4637672,0.99935734,0.5322712,0.21631742,-0.022453725,0.39751717,0.06697735,-0.10220692,-0.9941088,-0.3349295,0.41123176,0.11143449,0.43480816,0.44855762],
    [23,0,"CCN(CC)C(=S)SSC(=S)N(CC)CC",0.75431234,-0.034363374,0.17288008,0.13419794,0.09966113,0.2784739,-0.27182877,-0.44555014,-0.63895744,0.29839548,-0.8209554,-0.8119705,0.33077213,-0.16764721,0.5185161,-0.2916676,-0.907231,0.15558484,0.6199489,0.108245894,-0.062025934,-0.442701,-0.39304778,-0.4752085,0.11476858,0.2062064,-0.5743275,-0.08029889,-0.6390982,0.36486828,-0.027897608,-0.5014438,-0.2702577,-0.83969206,-0.31495336,-0.28997236,-0.41452238,0.35496658,0.97601813,-0.647792,-0.98662245,-0.65120935,0.54501003,0.61869735,-0.07910167,-0.93437916,0.68372524,-0.076195545,0.99651015,-0.46574298,-0.11822811,-0.7782775,-0.70054555,-0.23533921,-0.112908825,0.0792772,-0.31700695,0.57006145,-0.74878615,-0.003714419,0.08042217,-0.052340403,0.11398736,-0.36504886,0.03581884,0.77300555,-0.76846856,-0.14398682,0.5134206,0.39814016,0.44742212,-0.9350221,0.085316114,0.72556406,0.50867087,-0.93028325,0.49769515,-0.2127703,0.76195395,-0.99980587,0.38197488,-0.11015921,-0.4033982,0.5332648,0.45482624,-0.063722596,-0.43560776,0.013097554,0.58595395,0.6564159,0.7414649,0.6182122,0.31895113,-0.8093159,0.99245095,-0.03732856,-0.63863087,0.62008667,0.11051761,-0.44155777,-0.3358196,0.5211526,-0.091536656,0.25942093,-0.6149344,-0.31846163,-0.22690924,-0.028754262,0.9903709,-0.4881208,0.76148945,-0.17923686,-0.72538364,-0.9026172,-0.7240199,-0.32174134,0.29625154,0.31612587,0.99827963,-0.36108539,-0.3125812,-0.035896383,-0.19802141,0.2731544,-0.60376096,0.1809631,-0.013120944,0.4396028,0.2869438,0.9983452,-0.15403982,0.22322303,-0.22946027,-0.8047818,0.051667903,-0.9441939,-0.46162367,0.006371147,-0.37959427,-0.7563382,0.99955165,0.7387935,0.95410514,-0.694567,-0.05346449,-0.4502308,-0.41804782,-0.67235494,0.27317473,-0.6328085,-0.3863226,-0.7916112,-0.003124726,0.44490102,-0.045665715,-0.18361156,-0.12740235,0.97992283,-0.8563935,-0.9643562,-0.8725089,-0.5181246,-0.33948553,0.005608269,0.54093194,-0.41419733,0.2858301,-0.12596439,-0.2514161,0.57658845,0.17402852,-0.8840625,0.17577274,0.52367723,-0.6439739,-0.64667434,-0.77892226,-0.11720353,-0.5615373,-0.029659575,0.4401121,-0.18574415,0.32782406,0.39286223,-0.29126993,-0.42716277,-0.6005652,0.46312258,-0.10588199,0.061615404,-0.25657898,0.31726658,0.7384797,0.83317006,-0.4717033,-0.2925275,-0.5881843,-0.85792816,0.037760723,0.5676788,-0.26607266,-0.1771644,0.8203708,-0.6971023,-0.46009696,-0.102500826,-0.22768885,-0.648722,0.19109592,-0.9995411,0.122640684,-0.40759614,-0.80954397,0.8605385,0.52756673,0.056992915,-0.69577146,0.19176705,0.2283391,0.81088984,-0.28720304,-0.5151817,-0.48710018,0.38259178,-0.9908581,0.48044983,-0.12991162,-0.43869665,-0.082774356,-0.17213249,-0.8035237,0.30170947,-0.59839296,0.5324722,0.086957626,0.25626454,-0.2340656,-0.13605067,-0.20813712,0.71392345,0.74752355,0.11498211,0.008980941,0.43691418,-0.81249076,-0.6333206,0.77392346,-0.47287002,-0.7757807,-0.4515307,0.81360394,-0.9998586,-0.49854136,0.15346049,0.25161844,0.1565959,-0.052728377,0.003730462,-0.5682507,0.040736035,-0.11454565,-0.17959377,-0.35802525,0.005218789,-0.6968389,0.39500248,-0.08156476,-0.42604506,0.60160875,0.24336006,0.74927795,0.99800706,-0.61862725,0.76283675,0.55806434,-0.9647982,0.7876321,-0.86373806,-0.7265731,0.6205764,-0.05893036,0.9978229,-0.37509388,-0.77822083,-0.86288846,-0.5294449,-0.78762037,0.92748797,0.89127445,-0.73112726,0.5393152,0.9975584,-0.09697865,0.68075967,0.8166646,-0.38283753,-0.9991262,-0.92275345,0.4366219,0.35927838,-0.4990845,0.38751343,0.32232362,0.47755545,-0.5350303,0.33976528,0.810788,0.6912753,0.48247898,-0.15704325,0.103661716,-0.26177898,-0.8539563,-0.111250475,0.8561709,-0.16270894,0.38010758,0.17823616,-0.99993366,0.34521845,-0.2835892,-0.35293922,0.129162,-0.22690038,0.5383636,-0.9077231,-0.6488252,-0.6855514,-0.16599599,0.44645613,0.03294681,0.22682616,0.2154616,0.74324024,0.22819808,0.12463507,0.5236386,-0.92540026,0.56281346,-0.50890124,-0.54488796,0.22159177,-0.40991777,0.44849935,0.11081117,-0.17369208,-0.41711444,0.78549725,0.3228114,0.44073346,-0.9686092,-0.4349761,0.25398117,0.55291855,0.70280033,-0.7009286,-0.28684464,0.9998819,-0.71585184,0.02801299,0.19760579,0.12637751,0.5682934,-0.5472068,-0.16018902,-0.69469786,-0.2467416,0.63780355,-0.4754336,0.83992845,-0.71961,0.15530345,-0.6364226,0.48486522,0.12170099,1,0.41719016,0.28139102,0.21639468,-0.7269932,-0.4966216,0.07352569,0.63558346,0.8125568,0.21170597,0.39442292,-0.6629295,0.7273879,-0.063362285,0.11168083,-0.5144491,0.4245241,0.44484687,-0.3433837,-0.46311018,-0.97572523,-0.040554926,-0.8458527,-0.57678944,-0.8224126,0.19609568,-0.46965638,0.18916985,0.6903775,0.74158245,0.16994551,-0.32259125,-0.030564513,-0.23859914,-0.35813233,0.37894812,0.5256938,-0.11892155,0.3604116,-0.38800687,0.6456891,1,-0.6490523,-0.86285305,0.5406517,0.99875206,-0.4015298,-0.49075556,-0.9999722,0.30425292,-0.8518651,0.068205684,-0.8708315,0.13442297,0.38773942,-0.23645362,0.3242853,-0.05782595,-0.070653275,-0.66050684,0.06475058,0.6593785,0.48369825,-0.99988693,-1,-0.9792662,0.77099544,0.8010775,-0.658061,-0.5166001,-0.032193754,-0.6731253,0.79577345,0.904925,0.462108,0.4607579,0.41983652,0.38536748,0.23802722,0.2759015,-0.45478845,-0.54062563,-0.80196404,-0.99966013,0.13289256,0.91650367,0.68237066,0.5279411,-0.19112757,-0.9380721,0.34881687,0.66243136,-0.4159908,-0.20777634,-0.08696974,0.3495107,-0.88070965,-0.77339524,-0.41658342,0.69179654,-0.76345885,0.42439386,0.22422113,-0.13052885,0.47847202,-0.66782707,-0.2019911,-0.99814856,0.001122159,0.7361409,-0.347174,-0.20600086,-0.08679506,0.7514915,0.5686134,0.8446555,0.59384423,0.08528709,0.7479454,-0.39705148,-0.11908301,0.4278812,-0.7355425,0.51000476,0.99990135,0.47567528,0.14757839,-0.060328145,-0.2285569,-0.73113567,0.39875594,-0.9739689,0.04762517,0.36256352,-0.31740633,-0.2146408,-0.2607796],
    [24,1,"CC(C)=CCCC(C)=CCO",-0.6747766,-0.47018024,0.028043898,-0.16760683,0.051025316,-0.12098557,0.09054911,0.5305264,-0.5804297,-0.047292665,-0.555784,-0.278849,-0.26756904,-0.2603674,0.2636505,-0.30805603,0.49011058,-0.2311694,0.78402364,-0.28701267,0.22377716,-0.8762081,-0.41782972,-0.5134021,0.04260904,0.5677931,0.000444662,0.41370195,0.44145453,-0.22086698,-0.43923303,0.80904627,0.6267846,0.24117434,-0.22108231,0.31852713,0.27301347,0.84125614,-0.22705007,-0.8118259,-0.97050256,-0.593826,0.19731314,-0.23598975,-0.12375348,-0.9938624,0.48434347,-0.15535349,0.99418455,-0.3469558,0.15696442,0.3511048,0.72358966,0.37091845,-0.9381658,0.119558245,0.792184,0.97509617,0.29152587,-0.04079566,0.16420305,-0.5589627,-0.4620915,0.6672767,-0.6177707,-0.42686355,0.46411487,-0.17604749,-0.4418426,0.5314154,0.7562838,-0.94105,0.4373347,0.76840246,0.6923876,0.4664232,-0.16246438,-0.23855937,0.21101224,-0.99991655,-0.54996055,0.06964298,-0.09779393,-0.60644394,0.7625625,0.09024192,-0.05988966,0.028025804,-0.52025545,-0.22300234,0.1645726,-0.2821741,0.15798616,0.20440257,0.8469172,0.081815906,0.45279038,-0.41727418,0.63934714,-0.2365738,0.6583376,-0.3594988,0.18586792,-0.38151744,0.92067575,0.743985,-0.11156532,0.4264531,-0.64059323,-0.301317,-0.29424214,0.30565953,0.4521459,-0.020354101,-0.003902031,0.7223086,0.7615207,0.11203673,0.9980423,-0.001801001,-0.34292352,0.036424607,0.52818453,-0.49497667,-0.34540203,-0.4681471,-0.042496882,-0.1888665,-0.22171405,0.9997475,-0.17817418,-0.13507318,-0.16121057,0.56254965,-0.53518236,-0.8296222,0.6866953,0.22247772,-0.560423,-0.12516211,0.9991506,0.6032372,0.9962058,0.085370205,-0.43180218,0.5830468,-0.21194938,-0.255367,0.9798196,0.06170072,0.4374853,-0.9094299,0.37962136,0.648031,0.24345402,-0.55399066,0.22160304,0.99818903,-0.568084,-0.84089434,-0.9876262,-0.07382597,-0.07439015,0.5404819,-0.16608599,0.12127611,0.7013232,-0.12430168,-0.1205517,0.03886571,-0.18505347,-0.24342903,-0.12707546,-0.35721526,-0.5873074,-0.96896327,-0.37604082,-0.07957669,-0.32109964,-0.17555568,-0.80070966,0.36041242,0.3662375,0.09958284,-0.85083073,-0.054410197,-0.45754442,0.21130441,-0.6487291,-0.101505995,-0.23591495,0.42601472,-0.49665782,0.044760674,0.32569313,-0.76386184,-0.23213454,-0.40246394,-0.39311257,-0.68064564,-0.24962662,-0.32197598,0.33953464,0.29468802,0.026404032,0.61582166,-0.04416008,-0.005203665,-0.004722616,-0.9591287,-0.036460582,0.3537871,0.3113972,0.3155329,-0.29420444,-0.41598845,0.37662485,0.6220278,0.42151576,-0.024224589,-0.12381102,0.45881537,-0.38332152,-0.9023347,0.97901905,0.23924987,0.17653646,-0.6657861,-0.68271744,0.054964554,-0.5937861,-0.30512673,-0.13482068,0.16328545,0.35710657,-0.062375817,0.33249775,0.3038747,0.057688624,-0.049908295,0.8190923,0.3745995,-0.123517476,-0.59658796,-0.77621865,0.17760196,-0.065676816,0.1359339,0.47028548,-0.24192262,0.22263065,-0.999805,0.1252115,0.2592628,0.006049987,0.31455696,0.19000709,-0.5450668,-0.019305682,-0.4369157,-0.40334052,0.59497267,-0.31779376,-0.4647135,0.20382503,0.16508493,0.0791493,0.45934334,0.20772356,0.78363913,-0.16005883,0.66676474,-0.51954615,0.13397558,-0.40659696,-0.2569957,-0.22237363,-0.6968305,0.581751,-0.004063644,0.048342515,0.9995037,-0.7177848,0.5268057,0.68497336,0.36763796,-0.22959818,0.6382981,0.75598425,-0.23535939,-0.40755227,0.99921936,-0.247196,0.68635046,-0.30263832,0.006106278,-0.99795413,-0.9881963,0.6387329,0.25176126,-0.43241626,-0.4401985,-0.3687511,-0.6033042,-0.21104321,-0.91701454,0.9955817,0.4608082,-0.1785918,-0.2974905,0.61434025,-0.07260779,0.008754625,-0.14027858,0.94035625,-0.06436774,0.3866505,0.50010204,-0.9926929,0.02014903,-0.017533729,0.5463406,-0.19353242,-0.32702386,0.086295374,-0.18620293,0.50130576,-0.9092827,0.06939974,0.6704405,-0.048146307,0.15092616,0.13038471,-0.14697619,0.023256065,0.7413663,-0.41183585,0.43258703,-0.023055965,-0.6132407,0.53381443,-0.106677786,0.5262391,0.2489557,0.07225799,-0.38426045,-0.3289632,-0.15550725,0.28310415,0.9663844,-0.9956221,0.030030059,-0.68245316,-0.6184917,-0.27849293,0.14538307,0.51519775,0.9985035,-0.005580589,-0.32658347,-0.39113432,-0.0540015,-0.8063556,0.34391743,-0.6696392,0.48756635,-0.27875268,0.33067793,-0.21289209,0.5243462,-0.2557426,0.47628188,-0.09067958,0.9350311,-0.09078317,1,0.06879113,-0.04984573,-0.3816713,-0.4677527,-0.93328524,0.34521887,0.38864943,-0.19277513,0.32567337,-0.2977332,-0.14114964,-0.045121897,0.045030944,0.05364591,-0.41184777,-0.2965315,-0.72052264,-0.3732555,0.23065643,-0.9173371,0.38649285,0.002255879,0.03162757,0.08837044,-0.9602309,0.17624308,-0.64881456,-0.24309479,-0.10439588,-0.052017454,-0.538796,-0.79942507,-0.7339309,-0.467897,0.6488547,-0.06845298,0.055989567,-0.05315795,-0.3983943,-0.5476315,0.99995255,0.05082332,-0.70093817,-0.5384459,0.99861044,0.21393046,0.33631223,-0.99921703,0.60617447,0.30341458,-0.6689399,-0.13101746,-0.5870372,-0.36334902,0.2318909,-0.48685753,-0.12560305,-0.085924536,-0.6187046,0.036109347,0.43191135,0.24083662,-0.999879,-1,-0.9926185,-0.47607812,0.7213764,0.6662961,0.39730108,-0.68338966,0.6241187,-0.04405283,0.09634048,-0.025650347,-0.66232353,-0.123457946,0.027754005,0.1970255,0.36744216,0.37099597,0.29145893,-0.9851482,-0.9998226,-0.22060716,-0.24315421,0.06027531,0.02190404,0.29418677,-0.9905818,0.030653324,-0.5192631,-0.1539558,0.6083499,0.52596265,-0.11514489,-0.88123,0.10170415,0.24826099,0.6368671,0.8241508,0.43777263,-0.66331124,0.59439945,0.14518304,0.014252918,0.09790625,-0.7396982,0.63258827,-0.36972505,0.52685446,-0.075131305,-0.50293094,0.2196088,-0.31394565,0.40814453,-0.5116212,-0.16715606,-0.880705,0.4545318,0.47250086,0.6337095,-0.061230887,-0.07027559,0.99959433,-0.25598553,-0.40763947,0.7359019,0.22992353,-0.18681787,0.1365622,-0.043164294,0.6349435,0.024391856,-0.19454174,0.5786525,-0.009033757],
    [25,1,"COCC(=O)N(c1c(C)cccc1C)C(C)C(=O)OC",0.4328051,0.08997739,-0.66272646,-0.73734957,0.6163935,0.26355016,0.30083564,0.10529737,-0.11453149,0.60267127,-0.24898995,-0.20041887,0.5035974,-0.25652015,-0.11751321,-0.6131013,0.3810748,0.470809,0.23861401,-0.3694436,-0.15724236,-0.2562935,0.6123744,0.21218275,0.3384732,0.08302824,0.112639,0.68223447,-0.4478609,0.2600271,0.07067471,-0.41976696,-0.22813377,0.3072076,-0.24157271,-0.3548191,0.3772372,0.26924884,0.9949934,-0.20526756,-0.9705056,-0.87663543,0.15305,0.5149511,0.1685746,-0.90851307,-0.5114037,0.40314758,0.8989027,0.7635397,-0.798653,-0.5234897,-0.6090629,0.38053903,-0.5126669,0.035743874,-0.2768452,-0.20791678,0.1804574,-0.5166245,0.5163087,0.44032097,0.016641652,-0.40345126,0.049706116,0.28711107,-0.5524029,-0.20842174,0.18926601,-0.029020589,-0.9199245,-0.99771434,0.15516604,0.3582532,0.23059899,-0.07819664,-0.62783796,-0.11118883,0.3716968,-0.9998958,0.5346714,-0.7436498,-0.7956323,-0.3821738,-0.36278883,0.31844798,0.6181146,-0.7527039,-0.04863863,0.5630905,0.4797489,-0.20771836,0.094888486,0.34651753,0.9989323,0.019906871,0.005433412,-0.2536878,0.49441034,0.13417055,0.0792486,-0.22048526,-0.40035278,-0.14187174,-0.9213552,-0.66596943,0.41982487,0.075610854,0.97092944,-0.36548588,-0.05142906,0.2935148,-0.34629875,0.022686427,0.06432143,0.3784701,0.8304681,-0.27556282,0.9978725,-0.6481865,0.5671112,0.007147266,0.5205167,-0.3170053,-0.19223505,0.24608402,0.03216341,-0.033933066,-0.37535974,0.9913379,0.16937983,-0.4033153,0.47139508,0.41041374,0.09569753,-0.99070185,-0.007865483,-0.21126415,-0.7815373,-0.955213,-0.9904544,-0.18316144,0.8298276,-0.3960215,-0.4377668,0.510353,0.110838756,-0.11122812,-0.04102808,0.17505403,-0.033787776,-0.17697859,-0.60461134,-0.83444965,-0.35431147,0.2182758,0.09349207,0.82560545,-0.9031598,-0.8102828,-0.9302548,0.1383424,-0.16957863,-0.102997184,0.33678114,0.7803678,-0.31741658,-0.1691945,-0.5558133,0.45105973,-0.15121661,-0.013014979,-0.5266229,0.65848315,-0.15188475,-0.89287704,-0.53422487,0.32706723,0.0173165,-0.4036885,-0.43158957,-0.9840054,-0.110684626,-0.3718219,0.3168434,-0.6572003,-0.06724775,0.04634215,0.014909265,-0.4734773,-0.46047565,-0.27565283,0.176762,0.068445645,-0.58774716,-0.41264758,-0.025591329,-0.94326764,-0.25445232,-0.5955701,0.1208947,-0.5072012,0.0827086,-0.62628233,0.31388548,0.47209918,0.1597647,0.64484096,-0.298583,-0.99984,-0.25705704,0.0116095,0.46454036,0.1817834,0.11910845,0.2971448,0.040681195,-0.02054796,-0.45213524,-0.11138217,0.61593294,0.33384013,-0.6405915,-0.28726482,-0.99078804,-0.24277633,0.5360232,-0.58488667,-0.08673966,0.8277234,0.33282423,0.28091228,-0.06860676,-0.49865094,0.20183414,-0.5615248,-0.3363455,-0.12108248,-0.6127998,-0.08998783,0.8038044,-0.48587474,0.04712626,-0.70340306,0.12157783,-0.28280842,0.20862627,0.6308376,0.15634544,-0.2150486,0.32535484,-0.9983148,-0.5018514,0.05720049,-0.28880438,0.22185865,-0.18370457,0.112496905,-0.56915957,-0.10136262,-0.14978229,-0.3411829,0.09427293,0.75931656,-0.2050412,0.51704055,-0.81423885,0.76874226,0.9358832,-0.018625205,0.35224736,0.97164553,0.2535535,-0.01246962,0.13119757,-0.94681317,-0.38639534,-0.1866314,-0.79932284,-0.28525504,-0.3728123,0.9983411,-0.36273137,-0.60068494,0.4693756,-0.0983943,-0.31351465,0.7701367,0.70342326,0.16390978,-0.5818004,0.985556,-0.35829446,0.9605296,0.234251,-0.86044365,0.9955881,-0.80393535,-0.13214608,-0.43340492,-0.13143793,0.17001753,-0.17958117,-0.5395752,-0.6087225,-0.38650745,-0.51306045,-0.44991043,0.10929734,0.48388743,-0.061535753,-0.6239059,0.23361894,-0.10511105,-0.69777507,0.24532273,-0.53114897,-0.49413657,-0.99991703,0.044254456,-0.6902876,0.12747219,-0.40155038,0.36325157,0.12292005,0.8073155,0.083589785,-0.657827,0.53262097,-0.38493714,-0.13873936,0.45003852,-0.17982247,-0.012491585,-0.19178689,-0.86481494,-0.4061279,-0.30539024,-0.2889877,0.55810004,0.39013785,0.21656561,0.56977683,0.059543878,-0.42226246,0.10156541,0.35892963,0.42361197,-0.045801368,-0.3638553,-0.9573624,-0.34960076,0.44077632,0.22758494,0.2827535,0.3123003,-0.45183977,0.99978745,0.09927908,-0.19214454,0.10436174,-0.27780446,-0.5346327,0.18327211,-0.57517743,0.26122257,0.60671324,0.28840366,0.0758614,-0.6090884,-0.12580208,-0.35938162,-0.026713867,0.10251792,0.037190285,1,0.022126717,0.4388489,-0.117453724,0.014807471,-0.4575934,0.73940444,-0.6006364,0.1899934,0.20955864,-0.5144126,0.24377088,-0.65891004,0.4419274,0.009299981,0.12406556,0.043342374,0.69830096,0.20974885,-0.112513825,-0.9167397,-0.012811853,-0.26677528,0.8348998,0.16039194,0.56765646,0.16493283,0.55971813,-0.33537877,-0.13370523,-0.30697942,0.39379475,-0.23406664,-0.18506965,0.1869182,-0.62167704,0.17739701,0.101185784,0.29775265,0.08326624,0.73505884,0.9999998,-0.5724274,-0.97704506,-0.39371815,0.9997997,-0.11437179,0.1592226,-0.9999441,-0.27977857,-0.20769213,0.29890522,-0.31359917,0.26460564,-0.28576958,0.3290733,0.72549415,0.65453875,-0.8383795,-0.46510667,-0.4671888,0.6393707,0.3956088,-0.99995863,-0.9957914,-0.8967622,-0.45091587,-0.3746919,-0.43013665,-0.7104488,-0.018188398,-0.9388336,-0.0496081,-0.060211834,0.100549296,-0.46467215,0.055177275,0.5412548,-0.3638774,-0.2953196,-0.010711185,-0.3800261,-0.31061378,-0.99989176,-0.46517128,-0.17036428,-0.45042416,-0.30365503,0.32182446,-0.4285018,0.103483096,0.45440018,-0.20266275,0.09655459,0.32158577,0.3105645,0.9264801,-0.010719185,0.32945797,-0.61666155,0.3780453,0.1170984,0.5841974,-0.1844697,0.6029221,0.1759809,0.4257182,0.5987799,-0.003036865,-0.3998265,-0.041973505,0.3675191,-0.56141543,-0.417803,0.6228065,-0.19033642,-0.48011243,0.21078528,0.9751172,-0.73483735,0.6802402,-0.16728745,-0.4233249,-0.46206546,0.9995755,0.33917668,0.108910985,0.078260876,-0.0879903,0.3259354,0.32747617,-0.98920804,-0.49941984,0.45377934,0.22169265,0.6747624,0.4669835],
    [26,1,"CC(C1CC1)C(O)(Cn1cncn1)c1ccc(Cl)cc1",-0.5301587,-0.05147207,0.5445692,0.19860637,0.49557754,-0.697598,-0.70251405,-0.63581413,-0.08615381,-0.19547918,-0.2431335,-0.29194167,-0.0626481,-0.510686,0.57652956,0.020464255,-0.13254175,-0.31785876,-0.54539794,-0.13204414,-0.16730136,-0.28785494,-0.6188048,-0.5060989,0.3413401,0.48844367,-0.033102002,-0.017167374,0.46897566,-0.13916644,-0.44054824,-0.1256726,0.2651628,0.7362859,-0.114732094,0.16017388,-0.22996193,-0.6753548,0.9913956,-0.6748847,-0.53928065,0.19791898,-0.5302275,-0.2952253,-0.7028781,-0.82735384,0.35815915,0.3836145,0.62818277,-0.1714368,0.5358739,0.3973408,-0.4782345,0.00686464,-0.7351058,-0.29769114,-0.4741673,0.166154,0.2917633,0.5474828,-0.52055186,-0.04798129,0.1440012,0.38759044,-0.1708049,0.15123041,0.64364266,0.6240689,-0.6601993,0.24506494,-0.9238941,-0.974454,0.14292996,0.36303225,0.49765798,0.19947909,0.28944814,0.057579562,-0.43611228,-0.99943197,0.10114085,0.136334,-0.9186103,0.23161057,-0.3584366,-0.69224435,-0.05380581,-0.6336432,-0.76709163,0.12977384,0.4002275,0.5857665,0.5456576,-0.4070715,0.98793834,-0.096098356,0.40253538,-0.3224025,0.17856704,0.2713422,-0.22592147,-0.3699106,-0.30733645,0.9795191,-0.9496809,-0.8248533,-0.25536975,0.37115598,-0.7916777,-0.55000865,0.23637493,0.42649868,-0.27628464,0.23941037,-0.42144474,0.20775896,-0.78472376,-0.4821996,0.99571145,-0.22819646,-0.49693903,-0.7141685,-0.25234455,0.42505118,-0.4185446,-0.34559193,0.3790203,0.33961886,-0.13091305,0.9986266,0.71027106,0.041954134,0.16852406,0.5603092,-0.3413177,-0.9671301,-0.13443696,0.38014394,0.21363352,-0.58172387,-0.99999833,-0.4471481,0.9029485,0.36296704,0.46414503,0.12241872,0.35154346,0.28028965,-0.30568796,-0.22299302,0.35485244,-0.7077438,0.32144815,0.34229422,-0.008489643,-0.47836077,0.79616094,0.84788996,-0.45856136,-0.24228898,-0.9358714,0.08652864,-0.020186469,-0.59714556,0.3396305,-0.03287564,0.25114277,0.4310202,0.3476782,-0.8126436,0.25013477,0.58032304,-0.49191892,0.3239808,-0.53227603,-0.52375567,0.28791723,0.43224278,-0.45282242,-0.5305635,-0.5080992,-0.6100077,0.26546383,0.24778807,0.38742176,0.68918854,0.36137938,-0.07020555,-0.22066842,-0.40341532,-0.40652794,-0.15622085,-0.005675511,-0.16772035,-0.3973432,-0.2732614,0.4036889,-0.6618935,0.34140426,0.87471,-0.1923655,-0.04257897,-0.18025039,-0.3990097,-0.067553736,0.47147536,0.28362933,0.35606667,-0.10156499,-0.99968195,0.4065662,0.7918543,0.40845641,-0.42685315,-0.112437345,-0.1478197,-0.124613516,0.28714374,-0.35609823,-0.1908127,0.6303201,0.2185135,0.75960183,-0.1356268,0.96084416,-0.56378025,-0.1109985,0.44464633,0.6623821,0.6644617,-0.030580701,-0.39059082,0.31715086,0.50110745,0.4298221,-0.57561207,0.2075423,-0.743612,0.08050238,-0.63331527,0.9216723,0.61290234,-0.03245756,-0.50702196,0.18557939,-0.22763535,-0.72517127,0.5512569,-0.5515127,0.7308981,-0.28642935,-0.6240679,-0.40990233,-0.011196182,-0.5087656,-0.40783307,-0.008004271,0.6198202,0.8049344,-0.08116531,-0.32556733,-0.314098,-0.0552717,0.10584722,0.08564638,-0.32646018,0.120625764,0.3455993,0.2498665,0.16915742,-0.5557688,0.98976225,-0.041432768,0.60462385,-0.066074505,0.55089706,0.097255565,-0.88341165,0.4212619,-0.5013966,0.6210389,0.99900794,0.05001518,0.3461221,0.006310767,0.17271426,0.19671747,0.61352026,0.1972052,-0.48460987,-0.31105658,0.98902094,-0.027643647,0.09683187,-0.3226384,-0.8964634,0.99999964,-0.95975286,-0.04204359,0.21069148,-0.23180139,0.4360617,-0.07204474,0.35652986,0.87989193,0.07744999,-0.65628034,-0.72415817,0.7331374,-0.23515126,-0.025739126,-0.49336895,-0.14233254,-0.10453702,0.5519387,-0.6043843,-0.25479385,0.5128254,-0.9713488,0.43730915,-0.6651138,0.024646655,0.098436125,-0.5091859,0.090099335,-0.2839302,0.31054932,-0.56418204,-0.5635474,0.13569026,-0.51500434,-0.14113829,-0.5529792,-0.29472536,0.1440682,-0.19216524,0.17171066,0.47731605,0.007234864,0.03495796,-0.45667276,-0.8452875,0.5705546,0.5785719,0.7171623,-0.59532315,-0.8968263,0.028816532,-0.52684397,-0.23018806,-0.9681328,-0.38667467,0.17143166,0.4481196,-0.20667076,0.19333221,0.26928157,0.99985754,0.08592708,-0.17309965,-0.67317075,-0.088162005,0.09363654,0.5022066,-0.36917746,-0.20828432,0.11603593,-0.18517198,0.21053168,-0.70951706,-0.33220798,0.41141513,0.17952693,-0.31627077,0.47128057,-0.99756366,0.0338383,-0.6309418,0.48337853,0.09724997,0.19266404,0.55218846,-0.5723123,-0.41259235,0.41308397,0.5092914,0.2385431,0.264385,0.275397,0.122281834,0.4243503,0.5525541,-0.21212606,-0.08354118,0.09711942,-0.49516222,-0.6177386,-0.3067103,0.5109143,-0.17425518,0.09835917,0.36188605,0.13124566,0.43961412,0.756551,0.32233888,-0.6191664,0.22858264,-0.556471,0.5515452,0.44665244,0.37447935,-0.117381014,0.5216038,0.1434532,0.35011223,0.99995035,-0.30916706,-0.90715677,-0.09470922,0.9985206,-0.7201952,0.18767577,-0.9988414,0.62150717,0.14927493,-0.40616152,-0.4887365,-0.42485228,0.42716593,-0.17465262,-0.002770592,-0.3161822,0.098733135,-0.5434098,-0.41845068,-0.19224516,-0.34280205,-0.9999763,1,-0.64950776,-0.50421166,0.65022916,-0.32355925,0.86523736,-0.19557545,-0.41442502,-0.5272137,0.38044062,0.21028161,-0.35661492,0.16563632,-0.73363435,-0.64490527,-0.3928925,0.13664089,-0.7192835,-0.18420167,-0.999902,0.20542936,-0.7086016,-0.58177817,0.50191855,0.34492388,-0.8440879,-0.32636842,-0.38127217,0.16188848,0.19380651,-0.26365,0.138282,0.9265104,0.024663486,0.81296784,-0.12457996,0.18480544,0.1990881,-0.21936506,-0.69878733,-0.79117066,0.010958143,-0.4087173,0.037997644,-0.4120248,0.57234144,0.061478365,0.67184794,0.10405829,0.08562568,-0.07571716,-0.83010715,-0.031262007,-0.23076193,0.96746045,0.5893724,0.026337948,0.5152436,-0.06534477,0.5879208,0.9997754,0.37501764,0.44946784,0.08932011,-0.24121304,0.43606153,0.31037632,-0.99106085,-0.36211064,0.33700177,0.11284518,-0.08783841,0.33378178],
    [27,1,"C#CC1(O)CCC2C3CCc4cc(O)ccc4C3CCC21C",-0.6905903,0.27833098,0.20061137,0.36971265,0.052474745,0.07986202,-0.2585676,0.17270492,-0.63768774,0.49459922,-0.39343485,0.034355797,0.25350532,-0.5315277,-0.069849454,0.4711117,-0.3138641,-0.23730703,-0.1021003,0.2777124,-0.28689754,-0.30651227,-0.41512632,-0.27375054,-0.58347625,0.7166228,-0.34585857,-0.26621145,0.8066478,0.22872326,-0.13449629,0.31387687,0.83377445,0.41345593,-0.44361746,-0.18979512,0.31638983,-0.33701316,0.9990913,-0.6851591,0.19226874,-0.12337266,-0.08278902,-0.1499646,0.5139885,-0.62223315,0.5100137,-0.31881937,0.8422481,-0.31621188,0.66887546,-0.018057587,0.14699711,-0.019022899,-0.8652466,0.096214406,-0.15845053,0.30771434,0.6911174,-0.72975874,0.62002057,0.12578675,0.5073699,0.7121913,0.67606705,-0.6896044,0.20473139,0.0331667,0.13622783,0.5936144,-0.17769836,-0.6588904,-0.07169359,0.75694895,0.55129325,0.7687151,-0.34651533,0.120179854,0.14705624,-0.9991279,-0.9028027,0.31612855,-0.9628478,0.29165497,-0.058458388,-0.9127618,0.14834492,-0.41763157,0.034757514,-0.2669602,-0.59142756,0.08862669,-0.80703175,-0.0639605,0.99056995,0.11375875,0.538929,-0.7136853,-0.26378134,-0.55336344,-0.4792704,0.5526945,-0.09428735,0.8873038,-0.9926023,0.7512553,0.14904389,0.28940013,-0.9991212,-0.26034293,-0.2413759,0.24095106,0.4122984,0.47804096,0.6190194,0.28710654,-0.056123804,0.5604083,0.98360914,0.6024127,-0.45294175,-0.2826682,0.28072414,0.06312878,-0.52461386,0.48380286,-0.48895895,-0.3190473,-0.32462782,0.99995196,-0.025266387,-0.01998389,-0.24229641,0.14025566,0.13574304,-0.77656627,0.67980075,0.7950893,-0.014112568,-0.870793,-0.999965,-0.12067483,0.9267856,-0.15539978,0.8536178,-0.4369656,-0.5745338,0.40631375,-0.9431161,0.20353179,0.5750745,-0.8539709,0.9472747,0.22291839,-0.09997373,-0.6786497,-0.32509086,-0.1931117,-0.2936626,0.039224748,-0.9323782,-0.2747277,-0.032902237,-0.45928568,0.75258356,0.63216275,0.11609444,0.25271615,-0.21376477,0.6033189,-0.56886196,-0.3147821,-0.19181354,-0.37341616,-0.05494026,-0.97965366,0.6138711,0.63751024,-0.26286578,-0.13347429,-0.14854944,0.010166349,0.6099239,0.45206255,0.47790837,-0.4272018,0.37468353,-0.44061252,-0.15859695,0.34448785,-0.5649093,0.2962002,-0.085663915,-0.69726,-0.51798916,-0.19312231,0.5746551,-0.40952623,0.5580576,-0.0814029,-0.2662389,0.24829538,0.19370434,-0.23670618,0.29461968,0.07483124,0.24114162,-0.6943614,0.29646218,-0.9999525,0.18342781,-0.6708446,-0.043497965,-0.57876813,0.37394634,0.13707753,0.11779231,-0.024460915,-0.4426891,-0.2867053,0.12034978,-0.046958286,-0.7710245,0.44918105,0.9999508,-0.42281288,-0.22813258,0.608653,-0.13543741,0.5004757,0.522806,-0.68738186,0.8150881,0.3435337,0.1863664,0.5041533,-0.59424615,0.092286624,0.5877102,-0.7585816,0.82481176,-0.18693952,0.77981496,-0.066585265,-0.3629201,0.07574199,-0.07206396,0.014096167,-0.14874557,-0.75936055,-0.41820008,-0.36303207,-0.106387205,0.59363407,-0.44618434,-0.7917169,0.09824313,-0.29132864,-0.25374952,0.10901521,-0.73072624,-0.19906786,0.002951855,-0.79557866,0.3863603,0.54874617,-0.21012661,-0.024640758,-0.40004054,-0.2081152,0.10208604,0.99929476,0.16745573,-0.3130442,-0.57288826,-0.4922299,-0.7585684,-0.7584653,0.77733463,-0.2939031,0.14460574,0.9973017,-0.28003186,0.42203435,-0.3987158,-0.34132943,0.030145127,0.3528461,-0.8221628,0.5503049,0.55024946,0.8759557,-0.6794316,0.3773587,0.11378989,0.7935091,0.99999774,-0.9965635,0.6719218,-0.6309278,-0.31165847,-0.42567712,0.04440402,-0.3848226,-0.7260743,-0.9902151,-0.9354762,-0.32350913,-0.3699293,0.5512663,0.5987128,-0.06567813,-0.13117473,-0.6900546,0.7579414,0.6251367,-0.16705959,-0.21095777,0.935775,0.34065184,0.38538352,-0.12856366,0.5279283,-0.4001352,-0.7378519,0.1530549,0.44670695,-0.801261,0.13312666,0.3798469,-0.19111428,-0.33006957,0.39617065,0.04751451,0.23403397,0.67407924,0.084789805,0.22039127,0.5654626,0.06538992,0.6570433,-0.15803973,0.9492141,-0.2269195,0.112375766,0.608524,-0.113304645,-0.5008562,0.023695154,-0.7144605,-0.9527802,0.10236837,0.32530642,-0.22861277,0.39739603,0.2787642,-0.36879918,0.9994595,-0.47451556,0.08494604,0.35558534,0.63137436,-0.010687394,0.569061,-0.938005,-0.1235005,0.25398952,0.44325718,0.33790234,0.7120696,0.3370965,-0.01171879,0.5460773,0.36680216,0.3271508,-0.9999855,0.68480545,0.3474333,0.30777663,0.19424,-0.43032974,-0.44178888,-0.08920436,-0.51158935,0.28222075,-0.24824901,-0.312386,0.24080582,-0.15926445,-0.8875896,0.12410166,0.5560239,-0.13023435,-0.2706596,-0.12251728,0.42448542,0.63392055,-0.30042875,0.7480142,0.011030925,-0.29552615,0.30775994,-0.45498854,-0.3104155,0.14642045,-0.17476784,-0.36702946,-0.73365813,-0.017268881,0.39108694,-0.27720115,-0.3908813,-0.015050611,-0.6812111,0.32046744,-0.09939151,0.9265009,0.27250102,-0.9872772,-0.30839223,0.999121,-0.6875769,0.16175678,-0.9853817,0.5926687,-0.12384902,-0.32402042,-0.76886564,-0.3320527,0.3721268,-0.45385426,-0.8801978,-0.79143655,0.3132646,0.16632523,0.33331287,0.35313046,0.0518145,-0.99994415,1,-0.29923448,-0.6488343,-0.15823823,0.69854987,-0.21565779,-0.5876642,0.80744046,-0.56233984,-0.6733064,0.08726236,-0.29646993,-0.23713082,0.1717505,-0.48122475,-0.10006235,0.46498963,0.19330403,0.49828142,-0.99977094,-0.25011614,-0.46934637,0.46855426,0.77599216,-0.2162271,-0.96393466,-0.2486566,-0.21973523,0.03362807,0.39815268,0.49378017,0.54775345,0.8286064,0.40095916,0.70104754,0.43430638,0.6018286,0.5000226,-0.5885599,0.16925861,0.023615735,-0.4725673,-0.76604205,-0.9851139,0.22166516,0.000410059,0.4294127,-0.031297512,-0.00077126,-0.16272879,-0.8484676,-0.22018391,-0.029158508,-0.19727665,0.99582624,0.2046107,0.27188078,-0.7489846,0.26935527,0.48055235,0.999986,0.2180492,-0.68904865,-0.5256457,0.655556,0.6115834,0.70974535,-0.9975231,0.16853249,0.16979265,0.3186705,0.6961761,-0.35638404],
    [28,0,"CC(C)N(C(=O)SCC(Cl)=C(Cl)Cl)C(C)C",0.35715017,-0.2703127,-0.10927042,-0.1332052,0.27757126,-0.6014755,-0.19351819,0.35396376,-0.4138932,0.119192325,-0.7940072,-0.6289387,0.30385524,0.52670497,0.7400503,-0.85335195,-0.64183885,-0.33573046,0.43879533,-0.38137755,0.40374485,-0.35489643,0.558919,-0.32072765,0.27615952,0.5259796,-0.35538757,0.43602446,0.034365125,-0.117323704,0.12874173,0.65664476,0.10399901,-0.3070409,0.22485454,0.63830996,-0.4363514,0.8828498,0.97489405,-0.85622555,-0.972722,0.06269113,0.063901424,-0.1703369,0.31765133,-0.9433869,0.27549642,-0.69391257,0.9986269,-0.56697345,-0.23935324,0.3717847,-0.3555062,0.08449999,-0.63946706,-0.10368306,-0.070639096,0.3591397,0.001515663,0.5360679,-0.12958194,-0.21443611,0.24057956,0.6379108,-0.29569697,0.40455148,0.72087884,-0.15933146,0.42173964,-0.5805555,-0.28632006,-0.471937,-0.5223005,0.7802991,0.86552536,-0.77691925,0.39208183,-0.65614605,0.017638398,-0.9997235,-0.18204817,-0.34603193,-0.19355515,0.62530166,0.33404952,-0.8052238,0.038713712,0.001768203,-0.74729604,0.275914,0.47465444,0.31039208,0.6970873,0.3228742,0.9750408,-0.23819529,0.20956895,0.6941924,0.7569384,-0.076827414,0.6091854,-0.34937,0.7575105,0.24450417,-0.7411478,-0.14492866,0.41765204,0.31439173,0.98344684,-0.48407102,0.17906378,-0.50928736,-0.58371913,-0.36568117,-0.14051226,-0.06253419,-0.38273767,0.8358274,0.9980016,-0.6776283,-0.5287743,0.7751833,0.2591898,0.2820061,-0.6538156,0.3607382,0.12064267,-0.31413874,-0.00745679,0.9999572,0.56579876,-0.46163604,0.2790147,0.49364957,0.6401951,-0.9932702,0.16336025,0.092051804,-0.29756522,-0.76228297,0.9975001,0.6728079,0.9811123,-0.30228803,-0.52858865,-0.63361955,-0.37323123,-0.45247203,0.34777045,-0.24230163,-0.3942743,-0.43340313,0.21013314,0.117877364,-0.36754864,-0.19291991,-0.4284067,0.9746589,-0.9286542,-0.94390035,-0.8491988,0.51275045,-0.22783262,0.18826121,0.6430651,-0.64234555,0.8342012,-0.08420729,0.013092641,0.27280745,-0.1649418,-0.23711862,0.56724477,0.3829311,-0.15623656,-0.78268427,-0.65359324,0.5536438,0.10440911,0.14758247,0.2850742,0.13544093,0.039196618,0.04533582,-0.51137656,0.34840453,0.44991097,0.08235793,-0.53919864,-0.63064104,-0.80109227,0.19032381,0.4456003,0.28176436,-0.6173657,-0.5200052,0.48305252,-0.6273215,-0.3129054,0.58185494,-0.5285325,-0.5203653,-0.56779337,-0.30012915,-0.4876869,-0.32275724,0.63503593,-0.04096526,0.76245195,-0.9994055,-0.5384418,0.32171133,-0.300115,0.23458792,-0.5384604,0.25296852,0.5348181,0.033365466,-0.45121726,-0.52025634,0.5545015,0.24739222,-0.56984955,-0.21878003,-0.9702224,-0.37001467,0.7688536,-0.26498023,-0.6331098,0.57211906,-0.636776,0.40500355,-0.26989737,-0.14173034,0.55168116,-0.053506732,0.44981784,-0.08759003,0.003872288,-0.1710104,0.8623077,0.6459142,0.34661084,-0.87340945,-0.6439494,-0.4348348,0.8480554,-0.5567887,-0.12243841,-0.69176346,0.60852724,-0.9998425,-0.5383575,0.38231644,-0.086121224,-0.47524112,-0.43157905,0.31463248,0.11873966,-0.5114979,-0.6731756,0.5809294,0.62674445,0.093404196,-0.23310007,-0.1959016,-0.60424954,0.005934194,0.90671176,0.28745577,0.36540392,0.9933192,0.5521219,-0.06702565,-0.48510373,-0.41255513,0.6251559,-0.84641415,-0.7008981,-0.8252859,0.3623923,0.99890757,-0.5997623,-0.25479192,-0.06867523,-0.22993203,-0.5873592,0.96069586,0.82685614,-0.7866477,0.14475347,0.9965802,-0.35826308,0.35164082,0.09734641,-0.8206821,-0.99090755,-0.9938005,-0.12448686,0.6858909,0.14726181,0.27268118,-0.40137666,-0.8473397,-0.44650263,0.0750101,0.6064414,0.29043877,0.47240618,-0.30998453,0.76386267,-0.20074928,-0.6952896,0.17522453,0.88308716,-0.77084774,0.5768906,-0.012044228,-0.99995005,-0.6649976,-0.6345341,0.2479194,-0.03226051,-0.40874746,0.16593282,-0.66763735,0.20827761,-0.9781362,0.010054202,0.24577017,-0.68471867,0.2140917,0.53296924,0.7330973,-0.5283317,0.8473441,0.06855141,-0.28632927,-0.66184366,0.005149005,-0.38716096,-0.049334865,0.010460177,-0.15224268,-0.5865081,-0.24105184,-0.40966716,0.094882786,0.004663728,0.30743402,-0.9833279,-0.46176535,0.31513575,-0.1506266,0.7302876,0.32210743,-0.45817748,0.9998306,-0.6514838,-0.43257496,-0.8169932,-0.5334536,-0.15701042,-0.27824476,-0.7912427,0.22452527,0.5765383,0.772608,-0.41537845,0.10261396,-0.59679323,0.646698,-0.6045013,0.47451043,-0.09768839,1,-0.18145466,-0.045396395,-0.06456554,-0.50343883,-0.61219853,0.7172982,-0.02955007,-0.041255824,0.026681801,0.3099998,0.36381826,0.3854972,-0.07584258,0.2519012,-0.22967215,-0.13090114,0.2971562,-0.03053274,0.10737795,-0.9437099,-0.26496348,-0.74363905,-0.40314287,-0.89918506,-0.6452557,-0.7321872,-0.27157274,-0.050711047,0.2577208,0.113640174,-0.5857422,-0.5617888,0.05522043,-0.08980392,0.75315505,0.3645075,0.50914586,0.5069736,-0.56233835,0.82043266,0.9999998,0.7526293,-0.5887219,0.554874,0.99942297,-0.05428842,-0.24865782,-0.99995285,0.012698172,-0.57009465,-0.28757492,-0.89264756,-0.3819468,0.5085866,0.08316719,-0.7305578,0.5074476,0.86508226,-0.2187246,0.6125613,0.694948,0.045901798,-0.9999749,-0.9999999,-0.95427895,-0.23206107,0.2309948,-0.66002434,-0.1326484,-0.24359348,-0.48891485,0.12932417,-0.48471135,-0.11105863,-0.016548444,0.5187128,-0.29968104,-0.33056816,0.47542536,-0.41450578,-0.4757455,-0.7130923,-0.9998212,-0.28210855,0.082018055,-0.513883,0.3737868,-0.23756143,-0.9898644,-0.12502378,0.08336902,0.041046977,0.48679122,-0.22248495,0.2545094,-0.8979127,-0.28717983,0.017670266,0.2794158,0.13497278,-0.28846872,-0.35477084,-0.80212015,0.015658485,-0.30826908,-0.7008359,-0.95530146,0.34241024,0.25647342,0.0984686,0.37698582,-0.581778,0.32949898,0.58585095,-0.23564038,0.1294877,0.2953576,0.84499174,-0.40922755,-0.3512644,0.5382056,-0.27946687,0.5397228,0.99993575,0.42251238,-0.1656789,0.92407745,-0.21771574,0.4999905,0.30115905,-0.98179376,0.020399256,0.57027113,0.85029703,0.0822329,0.07854882],
    [29,1,"Oc1ccc(C(c2ccc(O)cc2)C(Cl)(Cl)Cl)cc1",-0.58090764,-0.22228384,-0.07400047,0.44844985,0.17088604,-0.61972016,-0.78492373,-0.52704746,0.5562204,-0.66430473,-0.6321255,-0.18999563,-0.29895595,-0.05904347,0.66170347,-0.05959919,-0.64237803,-0.20930481,0.29813024,0.30593595,0.32888266,-0.3260334,0.43644145,0.11772677,0.05324482,0.30429357,0.033419583,0.40755603,0.7939173,-0.5400145,0.13611,-0.13508469,-0.2731309,0.81526273,0.14627263,0.21968895,-0.29450968,0.7769564,0.9916082,-0.8825316,-0.8044752,0.18538703,0.000735695,-0.085466705,0.30557925,-0.911616,0.051646575,-0.27444395,0.9868493,0.07248309,0.004262942,0.18305239,-0.33077016,-0.27562615,-0.9159014,-0.07087606,-0.6637637,0.34668064,0.10974921,0.12611246,0.03203814,-0.4263372,0.3757054,0.18137053,0.27915573,0.5925494,-0.717441,0.12630637,0.11599852,0.5394347,0.10690071,-0.38147756,0.26829246,0.075779684,0.9402536,-0.59103054,0.28823063,-0.09280326,-0.09986637,-0.9948058,-0.90825903,0.33159137,-0.7816446,-0.3831532,-0.06821606,-0.88643676,0.06762138,-0.40201655,-0.70697886,-0.31099626,-0.015621607,0.5142727,0.4129173,0.35276318,0.69681174,-0.18895516,0.56886554,0.32717556,0.38590214,-0.15891692,0.20113058,-0.18717068,-0.14897165,0.7910804,-0.9391582,0.46968028,-0.48155266,0.73959666,-0.99904364,-0.009412468,-0.4685543,-0.48177338,-0.4873648,-0.5070158,-0.5741388,0.47584966,-0.019784015,0.80555475,0.99762934,-0.027393589,-0.36246157,0.31238145,0.2639572,0.03855405,-0.8029989,0.8226858,0.37865892,-0.5174396,-0.03423258,0.9999476,-0.32841438,-0.075351335,0.2090007,-0.22661935,0.083143234,-0.20801128,0.5860846,0.80155283,-0.6196372,-0.3244208,-0.9999778,0.043798376,0.984193,0.06913581,0.5658315,-0.6237744,-0.3837486,-0.5875622,-0.24661131,-0.12959637,-0.3176958,-0.637082,0.64730674,-0.36451966,0.048447046,0.09245631,-0.08618675,0.8322793,-0.8624736,0.22620481,-0.93632543,-0.23401754,0.28738216,-0.16787714,0.68883604,0.53092766,0.16263881,0.24730143,-0.19905455,-0.27897382,-0.67170316,0.39414573,0.0966153,0.21933798,-0.015427546,-0.973438,-0.8087836,0.23766227,-0.19885425,-0.089410044,0.027424142,0.33919004,-0.28511927,0.7008319,0.066619866,-0.12879558,0.7449161,0.6663163,0.07520571,-0.2473785,0.3432697,-0.05486116,0.03069755,0.49203932,-0.42740875,-0.22349808,0.4453559,0.51476437,0.64283663,0.3881939,-0.6025255,-0.37029982,-0.6718907,0.30873454,0.15943898,-0.6315196,0.5235544,-0.22296558,0.32839373,-0.99972844,-0.59871835,0.5295626,0.17923234,0.124505855,0.005179225,-0.2907189,-0.20126915,-0.043309566,-0.41759768,-0.20882557,-0.25505072,0.2543419,-0.38792807,-0.4213518,0.9998147,0.43693703,0.3937307,0.31957236,0.18351218,0.43824527,-0.34932524,-0.6255247,0.6732369,-0.0950628,0.10547367,-0.39328855,-0.8263855,0.36468348,-0.12742516,0.5655223,0.7862209,-0.19668965,0.111308016,-0.099934936,0.27758187,0.25389838,0.5271533,0.044014335,-0.12659405,-0.7851691,-0.57611066,-0.9771196,-0.72203606,0.6972734,0.44516933,-0.5690689,0.44885683,-0.10682922,0.4984949,0.42027062,-0.35667613,0.47673506,0.6140262,-0.34090862,-0.011908019,-0.31395185,-0.065994814,-0.024166023,-0.5103393,0.6271471,-0.5580661,0.9678688,0.3322905,-0.7462134,-0.73759294,0.90426874,0.22381285,0.10471921,-0.17245272,-0.58283466,0.58323306,0.99866414,0.25612825,0.64576304,0.1358415,-0.19246168,-0.6105713,0.058471262,-0.6917805,-0.49336854,0.5259413,0.98753786,0.17365167,0.586952,-0.40611634,-0.7635963,0.9999727,-0.99649566,0.28774866,0.5279303,0.00113895,-0.65850466,-0.56022006,0.42137387,-0.46973902,-0.9372207,-0.11086111,0.29973185,0.5918432,-0.10693366,0.15932178,-0.036403198,-0.28247312,-0.40297708,0.8403393,-0.72031724,-0.15563516,-0.08343955,0.94318825,0.33915004,-0.06707985,-0.34563488,0.48458686,-0.69095546,-0.5244499,-0.6636801,0.62042606,-0.9370733,0.5233202,0.22230022,-0.06536112,-0.6110081,-0.115599915,-0.13548543,-0.52194387,0.89657444,0.18208827,0.0683697,-0.39559558,0.4484551,0.09123422,-0.5845934,0.10908869,-0.12025572,0.17141332,0.017868504,-0.59419066,-0.78657323,-0.6776615,-0.14580049,-0.9770043,-0.17296934,-0.749057,-0.015704457,-0.047332432,-0.23016739,0.14156702,0.9998823,-0.020092983,0.6379043,-0.19294314,-0.52080387,0.23877597,0.2869196,-0.9018688,-0.20768315,0.54151237,0.07981773,-0.38610777,0.17341188,0.001343008,0.25251192,0.51188713,0.59526414,0.5820953,0.99714947,0.14056014,-0.055029113,-0.3745577,0.5144466,-0.698658,0.565217,-0.56381184,-0.76828754,-0.8292009,-0.27359003,0.63464624,0.69833255,0.063910946,0.39487532,-0.15297829,0.6770071,-0.2951746,0.59494704,0.0319233,-0.40229422,-0.72326696,-0.5583603,0.644258,-0.5423622,-0.7459249,0.26468697,-0.10769659,0.13085397,-0.3008022,-0.25161362,-0.5741311,-0.4749287,0.3557581,0.6746597,0.45774245,0.42896166,0.17951393,0.5405276,0.35559997,-0.05042243,0.86620337,0.049156107,-0.9852111,0.79258955,0.9993464,-0.7647908,-0.7662288,-0.9564832,-0.10398788,0.3507388,0.48258185,-0.4515585,-0.14347412,0.1908195,0.09574464,-0.7346608,-0.40089312,-0.48418713,0.102203175,-0.000275576,0.33199862,-0.07416514,-0.99999213,0.9923477,-0.9156535,0.17053455,-0.5936943,0.19399026,0.55425817,-0.9103335,-0.74512106,0.3155802,-0.5477627,-0.2097675,-0.8433655,-0.35345617,0.2664749,-0.75759125,0.56142545,0.43573123,-0.16139494,-0.3303741,-0.9999267,-0.33669087,-0.09878449,-0.07706089,0.3984804,0.08378886,-0.98680454,-0.048198603,-0.8117631,0.003513154,-0.05466432,0.08225295,-0.4574839,0.928555,-0.52733094,-0.38417226,0.33779192,0.50552696,0.2764775,-0.8398719,-0.7923328,0.63649833,-0.5086502,-0.6443172,-0.98365515,-0.047477625,0.17202105,0.006186681,0.13188419,-0.37307394,0.13069504,0.68383604,-0.7012543,-0.379555,-0.025206083,0.91785544,0.074843295,0.23329349,-0.3294994,0.25902894,0.63257664,0.9997132,0.75001943,-0.3184437,-0.735306,0.20762344,0.27055514,0.3436995,-0.97823066,-0.2951625,0.7216858,-0.17996779,0.03669077,-0.03207416],
    [30,1,"N#Cc1c[nH]cc1-c1cccc2c1OC(F)(F)O2",-0.2414073,-0.04695626,-0.0763663,-0.35960642,-0.24343154,-0.35260165,-0.4077081,0.032307208,0.34140176,-0.029331615,0.5580673,0.32403538,0.038207233,0.57433826,0.20116921,-0.03226383,-0.22237031,0.6923804,-0.16676247,-0.21657093,0.26580963,0.01918353,-0.38685584,0.8113218,0.39813286,0.4583359,0.12661086,-0.14237,0.7557705,0.4915711,0.77397645,0.3867889,0.05215704,-0.7656836,-0.31451878,0.08046084,0.83674043,0.6085647,0.98614526,-0.8012988,-0.84418607,-0.12643972,-0.20178579,-0.3964622,0.19999869,-0.94540566,-0.5949263,0.46772715,0.34740287,0.12270025,-0.05194889,0.53857994,0.29058698,0.33115515,-0.79956216,0.13191491,-0.8267478,0.5721802,-0.43073934,-0.04581346,0.41360477,0.19346538,-0.10439383,0.06203465,-0.3687345,-0.19774681,-0.34595412,-0.65781236,0.5860796,-0.02549235,-0.7851187,-0.9770208,-0.14958918,-0.6216906,0.35191238,0.30085027,0.74925715,-0.19963521,-0.17586875,-0.9997371,-0.23697408,-0.49675187,-0.94388497,0.3397487,-0.7227989,-0.22266588,-0.25199407,0.002606993,-0.31569627,0.14673841,0.045386985,0.22820058,0.24928871,0.17436674,0.9907462,-0.484625,0.38758862,0.42556044,0.34275204,0.39055803,-0.13372004,-0.64434105,0.39715663,0.6530255,-0.8307411,-0.5575428,-0.14811113,-0.051317796,-0.9908479,-0.091905914,-0.69226545,-0.38488582,0.20809802,0.884635,0.6054389,0.40714735,0.33231983,0.43743464,0.9987872,0.12657747,-0.33488646,-0.08863174,-0.2083298,0.34923494,-0.42902112,0.34536982,-0.4530801,0.4448283,-0.15129498,0.9985217,-0.59707874,-0.050798766,0.1872589,0.014324868,-0.25611195,-0.9767237,0.508314,0.56595635,0.18260986,-0.38276777,-0.9999985,0.19298446,0.93970543,-0.003672486,0.4836109,-0.11985188,0.42307043,-0.067678034,0.40000838,0.14659378,0.16115399,-0.43247375,0.04006473,0.46215683,-0.1750149,-0.13317704,-0.18474714,0.9497409,0.12351067,-0.49184543,-0.9671242,-0.052517187,-0.012092793,0.019321688,0.6311915,0.61825037,-0.40333194,0.17803496,-0.3557144,-0.17065486,-0.21775165,-0.48548722,0.28073558,-0.07846885,0.709217,-0.93861026,-0.6314055,0.3630979,-0.03711243,0.007565077,0.42111033,-0.83236396,-0.08594454,-0.48644954,-0.25236887,-0.36627966,0.5315511,0.5132818,0.72109234,0.22304346,0.55486715,0.37632987,0.4142066,0.11625569,0.053880084,0.63865876,0.39397088,0.10584029,0.70895493,-0.35544765,0.19981125,0.7949824,0.21321169,0.2574204,0.21610785,-0.6626017,0.81296706,0.037492845,-0.2550712,-0.99971676,-0.029291026,0.3035363,0.33993286,0.06147233,0.029119741,0.6589804,-0.43728936,0.21521336,-0.19816697,0.2849495,-0.15374416,-0.28373665,-0.08547353,-0.37493142,-0.8361852,-0.001201573,0.08854258,-0.2562693,-0.16786025,-0.5712661,0.004609939,-0.2766019,-0.53408575,-0.5033096,0.4959594,-0.26912,-0.4735356,-0.24447358,0.15217507,-0.15934919,-0.97492445,0.06383521,-0.12686278,0.016566096,-0.15008308,-0.5698202,0.50900644,0.84434384,-0.06277883,0.48634917,-0.05332666,-0.7508254,-0.5473505,0.56348777,0.52094936,-0.5077476,-0.4651347,-0.50758654,-0.11968755,0.47940928,-0.044217203,-0.4742816,-0.32666647,0.6923964,0.5862992,0.5004423,-0.29368043,0.5104606,0.20962782,-0.13396503,-0.54633665,0.9932999,-0.35636428,0.58760047,0.11104752,0.8205406,0.2881669,0.15478,-0.017928483,-0.046816003,0.22706908,0.99941254,0.45795524,0.6892202,0.4467562,0.8606326,-0.80713284,-0.075502664,0.77405506,0.21675584,0.3667997,0.99581414,0.24966612,0.5415086,-0.14521015,0.15457737,0.99999994,-0.96848667,0.11024336,0.07931842,0.5327923,-0.005571987,-0.046390843,0.019743007,0.2587955,-0.102811985,0.28556496,-0.023155842,-0.23596373,0.3221268,0.6100295,-0.47502732,0.11227086,-0.46777233,0.37996772,0.27084675,-0.6951405,-0.51291525,-0.90630645,-0.3563532,0.8394999,-0.45412937,-0.6025813,-0.58671707,0.58879566,0.67177916,-0.6249132,-0.6878886,-0.35063782,-0.15003411,-0.5756845,-0.34392926,0.17969778,0.2992628,-0.2097889,0.051111,-0.39205486,0.2923824,0.26668322,0.13261953,0.35355031,0.55123067,-0.38524452,-0.24495988,-0.41381103,0.38210395,0.17856774,-0.42127866,0.0671064,0.11339933,-0.98573065,0.46203372,0.118104525,0.6871188,-0.30596608,0.17804618,0.5536583,0.99989957,0.56161433,0.14806968,-0.63349944,0.40679145,0.6336039,0.31983843,-0.7935271,0.38245097,-0.5995021,0.13094541,0.16227996,-0.060336553,0.070782036,-0.3050563,0.50725484,0.3802229,-0.624756,-0.9855497,-0.5488495,-0.008464159,0.32265782,0.07507833,-0.66769123,-0.12027641,-0.38231465,0.3070362,0.0934695,-0.36242327,0.08506206,0.17338012,0.09185355,0.2852402,-0.14572568,-0.6824066,-0.63805133,-0.22857945,-0.010985956,0.15217905,0.5032019,0.61359984,0.7003547,0.2752013,-0.23512691,-0.065325,0.13975987,0.02231063,0.07663481,0.1784513,-0.43070972,-0.62412405,0.7305299,-0.4951079,-0.03302927,0.49449396,-0.35109374,0.26123467,0.8534967,0.08747615,0.99982184,-0.06985288,-0.893549,-0.34304115,0.99961853,-0.67144746,0.57124066,-0.99741226,-0.091373645,-0.12449448,0.55070955,-0.43470734,-0.16747801,-0.44298834,0.25138304,0.15010424,0.76677763,0.29540524,0.040981993,-0.58446133,-0.43732053,-0.7268273,-0.9999893,0.9999999,-0.9335263,-0.33111343,0.003736245,0.31995603,0.42579964,-0.5828484,-0.5703576,-0.4605603,-0.5979061,0.14084108,-0.87236446,-0.28733113,-0.6964095,-0.44500762,0.15541933,-0.1993912,-0.1859233,-0.6659929,-0.9999562,0.47604814,0.090201944,0.15279453,-0.7581287,0.22734399,-0.8087498,0.17360705,0.18271387,-0.020489452,-0.6416539,0.3419211,0.448698,0.9797307,0.2902609,0.94594216,0.58690506,-0.2353945,0.5972663,0.0608237,0.2439537,0.6941213,-0.4707202,0.41625896,-0.38254523,-0.15107389,-0.15720859,-0.31007504,-0.06378316,0.3416454,-0.5566783,0.4816322,-0.50674874,0.057852864,-0.4134056,0.85995424,-0.21871717,0.686601,-0.64360684,0.3689276,-0.056119166,0.9995148,0.10999171,0.17825007,0.033907056,0.5163874,-0.23359041,-0.39414033,-0.96799237,0.20426297,0.55549675,-0.48918664,-0.4155468,-0.016805016],
    [31,1,"CCC(C)(c1ccc(O)cc1)c1ccc(O)cc1",-0.7292222,-0.27080658,0.008062146,-0.4656232,0.64847064,-0.5342819,-0.59043276,-0.14604084,0.051706467,-0.13965023,-0.88235605,0.16271818,0.03905515,-0.81523776,-0.27771756,0.52852607,-0.085451156,-0.5016052,-0.058358017,-0.27732792,0.15744331,-0.7179456,0.5436071,-0.38882017,-0.035540555,0.37863046,0.19763729,-0.13783409,0.8607408,-0.17149502,-0.4075311,0.02918116,0.030254869,0.18717161,-0.1703077,-0.37012744,0.44778442,0.34325373,0.9817948,-0.8298388,-0.8971303,-0.06764631,-0.14159065,0.03982409,0.50478905,-0.9560608,0.037829515,-0.052232426,0.9645329,0.29914188,0.5716274,-0.002197087,-0.48121604,0.14231397,-0.9306506,0.2235059,-0.6603219,0.64521635,0.42853016,0.050671045,-0.3191398,-0.2718184,0.28986424,-0.3624461,-0.43447757,0.533062,-0.29093438,0.5241612,-0.21400914,0.24783982,0.4525503,-0.71983767,0.03532511,0.026832292,0.79220915,-0.044433765,-0.17681114,-0.4032003,-0.54637367,-0.99365497,-0.9002143,0.48967952,-0.889869,0.18842228,0.25651708,-0.82940346,-0.11134278,-0.38973722,-0.14217441,-0.45497814,0.26896507,-0.060462527,0.0652546,-0.35576403,0.68500614,-0.25553828,0.7537565,-0.026202498,0.28415522,-0.04918338,-0.041573104,0.2986895,0.029817397,0.734755,-0.8013482,0.43078113,0.31659386,0.19591403,-0.9979961,-0.3590844,0.015708257,-0.39235362,-0.16553377,0.040111188,-0.05203887,0.67249286,-0.37194994,0.39520457,0.9979737,0.45655012,-0.21438858,-0.56104594,-0.5476614,0.026673632,-0.6817288,-0.12652504,-0.37118125,-0.26020646,-0.39959404,0.999878,-0.26748616,0.2394408,-0.41006872,-0.10347071,-0.28198317,-0.688555,0.48337662,0.8700691,-0.8419369,-0.5219393,-0.9998895,0.42846355,0.98702455,-0.05829885,0.14758436,-0.28232312,0.019284528,-0.20971702,0.3063013,0.13565007,0.33237994,-0.92805785,0.48739073,0.123675786,-0.3902006,0.086276986,-0.074871555,0.92540157,-0.7734136,-0.25507477,-0.97907305,0.14837274,-0.2475214,0.20377013,0.3816665,0.5578614,0.84879714,0.34844324,-0.47736734,-0.34534672,-0.4893797,-0.30955532,0.5236627,0.27048326,-0.19441451,-0.9820616,-0.7844267,0.36365604,-0.50763756,-0.3512,0.16512343,0.036143064,0.120479345,0.6152799,-0.010047707,-0.31432617,0.018480273,-0.09574443,-0.13364801,-0.1364719,0.33336222,-0.06510208,0.33853716,0.4837604,0.26511073,-0.761785,-0.21641487,0.5458056,0.22821175,0.08381909,-0.53592515,-0.045918956,0.45229596,0.050195485,0.6107008,-0.12907639,0.19768864,-0.1025893,0.09193401,-0.9994237,-0.4282955,0.2310655,0.40633762,-0.19132467,0.6277651,0.38627538,-0.04315703,0.6685349,-0.46749076,0.033182293,-0.07154545,-0.20152964,-0.3171439,-0.3416759,0.9999408,0.09450764,-0.23745011,0.4060603,0.35249594,-0.116559535,-0.35681975,-0.61975235,0.7483297,-0.096094824,0.44918382,-0.38903412,-0.001483742,-0.58609176,-0.36389148,0.4096719,0.7723927,0.5524457,0.2733619,-0.69647557,0.52817106,0.4642569,0.46662426,0.16774194,-0.41109288,0.0392075,-0.2715624,-0.97030866,-0.3094522,0.30478257,0.59877247,-0.38066897,-0.53752834,0.0374682,0.7923191,-0.054970194,-0.60350615,0.6437722,-0.5485286,-0.41078877,0.5356597,-0.09158675,0.49359637,0.56013006,-0.8580342,-0.027748296,-0.7225099,0.8918599,0.23340979,0.3029731,-0.3537007,-0.27901867,0.1984873,-0.3369263,-0.025311282,-0.13575166,0.6324636,0.99932057,0.19077966,0.22096846,-0.16868067,0.32375032,-0.17201939,-0.12705487,-0.47898874,-0.18750253,0.38270128,0.99381757,0.40217823,0.679765,-0.09133592,-0.4815683,0.9999776,-0.99521357,0.42008913,-0.08834884,-0.057260923,-0.39795667,-0.52667356,0.36214483,-0.2621276,-0.9788007,0.31400627,0.32342944,0.407353,0.22393265,0.39314437,-0.27844757,0.19776846,-0.3660176,0.76778406,-0.33903033,-0.3913994,-0.19468471,0.9377224,0.51030505,-0.092160165,0.12588574,0.42056385,-0.67032367,-0.6341334,-0.61147577,0.38312435,-0.9190054,0.48083454,-0.12415674,0.5151963,-0.21937838,0.29910624,-0.43828067,-0.3027753,0.78225034,0.1493793,0.53382134,0.08644574,0.13319989,-0.6189661,0.35271612,0.38537532,0.34082997,-0.016163835,-0.1359107,-0.7382255,-0.44942394,-0.31095716,0.27657405,-0.98767227,0.14110847,-0.45150355,-0.082779974,0.4201542,0.06698152,0.4732445,0.9998052,-0.14542459,0.100000255,0.1424625,-0.10720071,-0.6682219,0.28708202,-0.9187505,0.19345832,0.07071114,-0.11981601,0.06722966,0.63999873,0.7071171,0.5534037,0.46051496,0.7760316,0.77175367,0.99691397,0.4948556,-0.12718742,-0.14293595,0.3193511,-0.812293,-0.39379945,-0.47151133,-0.59494555,-0.21880335,-0.16701558,0.37697393,0.37803742,0.047146495,0.5331149,-0.20232248,0.60061467,-0.086036354,0.19756934,0.02057437,-0.3746476,-0.7280849,-0.69976807,0.7506758,-0.26427287,-0.89030594,0.36894318,-0.3374447,0.16139726,-0.28842834,-0.3485967,-0.43576604,-0.6770267,0.03633391,0.010337684,0.0862987,0.5067005,-0.3140778,0.51114196,0.47343487,-0.5355663,0.92919725,0.103019364,-0.97401595,0.14027753,0.99949265,-0.33070585,-0.4065341,-0.9701202,0.2173944,0.30811137,0.6823782,0.44586343,-0.51432014,0.8730219,-0.5935561,-0.65241957,-0.44182926,-0.20398223,-0.472717,-0.31030178,0.12471501,0.14828072,-0.9999799,0.99085957,-0.9155287,0.09165082,-0.24640718,0.42184603,0.045363873,-0.81602126,-0.56193966,-0.22073217,-0.56218755,-0.09157605,-0.8807892,-0.48559287,-0.2818913,-0.4314942,0.14488125,0.06935122,-0.071024165,-0.66298836,-0.99994534,-0.56432873,-0.36928868,-0.18507566,0.41013074,-0.47220764,-0.9889572,0.19288366,-0.7198381,0.17884278,-0.1500941,0.055261344,0.12449343,0.9529939,-0.42386594,-0.3189915,0.5457968,0.49432415,0.21340904,-0.9356983,-0.41450602,-0.6192266,-0.12667821,-0.14308381,-0.92846817,0.0641595,-0.11900538,-0.6855332,0.050166026,-0.7188922,0.024712333,0.6644129,-0.4909931,-0.40074122,0.6398125,0.8901313,0.11550319,-0.36341125,0.010469377,0.014865792,0.1050038,0.99973094,0.6202668,0.14760613,-0.43572968,0.53694314,-0.061838433,-0.045089323,-0.95441586,-0.33062235,0.74074435,-0.26293847,0.5311831,-0.25786838],
    [32,0,"O=C(Nc1ccc2[nH]ccc2c1)c1cc2cc(F)ccc2n1Cc1cccc(F)c1",-0.83844626,-0.18447433,0.06985668,-0.43558472,-0.031872857,-0.5451823,-0.15689076,-0.46269792,0.14258878,-0.002195879,-0.8106025,0.05477422,-0.26801962,-0.5558699,0.3225295,0.31045264,0.044657957,0.42211336,0.6212902,0.044359714,-0.19587402,-0.61013556,-0.4100986,0.36799434,-0.18710735,0.3477063,0.44219702,0.27045023,0.6109168,-0.079498194,0.39675847,-0.0777366,0.26194298,-0.11742552,-0.18947594,-0.21687955,0.12475105,0.73212546,0.999575,-0.7520231,-0.4321177,-0.038675748,0.04617166,-0.26243624,-0.4207841,0.5857061,0.37531006,0.122958384,-0.13730393,0.36951488,0.28362262,-0.16242015,-0.14436808,-0.15081348,-0.15381591,-0.16761832,-0.6889424,-0.832982,-0.5665087,0.43885803,0.40086606,0.26223078,0.68441963,-0.19814503,0.2843359,-0.3611492,-0.09988549,0.09355933,-0.2866017,0.3975276,-0.9786042,0.10574345,0.13786072,-0.8905429,0.7863026,-0.39521682,-0.21193333,0.006592072,-0.24751022,-0.99847054,-0.32484347,0.3941467,-0.8914061,0.23566051,-0.016248327,-0.9861762,-0.1877485,0.108710475,-0.33951813,0.19868225,0.28263858,-0.0783256,-0.08694127,-0.30867565,0.97456336,-0.29313368,0.798155,0.29879004,-0.17952241,0.271292,-0.36225277,0.7810406,-0.37371066,0.9876391,-0.999398,0.2998235,-0.4093983,-0.3213827,-0.9998756,-0.69458675,0.07874259,0.019206842,0.5208425,6.93e-06,0.40073365,0.4147475,-0.2099461,-0.27379522,0.7346811,0.30289587,-0.46525127,-0.4402132,-0.5647085,0.13003357,-0.6822502,0.53535336,-0.48727322,-0.15756918,-0.04721235,0.9999848,0.55523765,0.22264405,0.47269684,-0.4681639,0.24004936,-0.99340343,0.7890164,0.5124565,-0.098331384,0.2083536,-0.9999995,0.56362474,0.7517622,-0.33204567,0.39974728,0.26872534,-0.34940985,0.030349057,-0.995371,-0.45778248,-0.28337282,0.8499711,0.66704905,0.03956733,-0.5381756,-0.07496592,-0.47632387,-0.96087235,-0.5669046,0.83490777,0.1193157,0.54764616,-0.29247913,0.03871626,-0.10376062,0.10754034,-0.04388233,-0.16542369,-0.6906611,0.14394617,0.39496663,-0.19747835,0.11599485,0.118467435,-0.31752563,-0.8979782,-0.7101872,0.28635,-0.07620243,0.110563934,0.24697009,0.36711687,0.3831221,0.2538949,-0.010760711,-0.68594104,0.38630563,-0.08643552,0.14132303,-0.19401917,-0.27049768,-0.3730123,0.45598745,0.303186,0.07916847,-0.43571955,-0.12831253,-0.60541487,0.85253185,-0.44023794,0.49870342,0.07855117,-0.84688014,0.8008467,0.2458899,-0.40392622,-0.018433917,-0.2631192,-0.3929969,-0.999922,0.25662485,-0.11222638,-0.10140788,-0.09411098,-0.41646013,0.051340673,-0.41185042,0.55715406,-0.43129963,0.25892398,-0.42818606,0.24984558,-0.81598705,0.054751273,-0.9450991,-0.1443305,0.19044626,-0.36180067,-0.1845444,-0.53516775,-0.40338442,-0.5134797,-0.1807286,-0.683996,0.42174366,0.06560912,-0.5021423,0.26679063,0.12928353,-0.44258806,-0.96622074,0.02046709,0.2909074,-0.832133,0.7778203,0.36500221,0.006669642,-0.56088424,-0.28650913,0.3658949,0.72625065,0.7180806,0.40395826,0.44756883,0.7061523,0.16480246,-0.30047753,0.50322676,-0.091120385,0.68470705,-0.38150695,0.5483369,0.071657896,-0.20292443,0.67169726,-0.0194877,0.15607281,-0.31044444,0.40990776,0.0404809,-0.54683423,0.9594601,0.3240112,0.4654339,0.58021843,0.7865857,0.699955,0.29206425,-0.22709332,0.1114382,0.2961855,0.98148,-0.110016845,0.61311567,0.088053375,0.4670307,-0.3739061,0.53536135,-0.9258654,0.1457421,0.28435227,-0.36722225,-0.50829214,-0.535175,-0.16983576,0.6969409,1,-0.9987508,-0.30090308,0.45803776,0.14174017,0.12490741,-0.6561526,-0.39517242,-0.02229077,-0.7115867,-0.99885446,0.45349094,0.8140692,0.38390484,0.25011426,-0.20385584,0.02705741,-0.09360958,0.86380166,0.32773125,-0.51473683,-0.31649366,0.9775044,-0.17035666,0.08162111,0.39392972,0.068376735,-0.76995003,-0.7923386,0.017834201,0.19289537,-0.961548,-0.33107033,0.43665117,-0.28228927,0.5423941,-0.11888286,-0.4205408,0.6393312,0.9600375,-0.040263325,-0.40241992,-0.061287988,-0.26620352,-0.15955062,0.34473,0.30013806,-0.39774144,-0.10664979,0.7962395,-0.4777291,-0.22805972,-0.33744046,-0.9824179,-0.7479969,-0.24677391,-0.5694948,-0.13952708,-0.1471558,-0.16807242,-0.10932812,0.9994516,-0.07994535,-0.89839554,0.21013077,-0.10331156,0.15948835,0.64511675,-0.9831924,-0.4882898,0.24098445,0.087558374,0.5699711,-0.007816216,-0.66607225,0.07906641,0.27166352,-0.19300014,-0.3685304,-1,0.17184234,0.14729844,-0.7547377,0.3121724,0.19591317,0.30081967,-0.3365029,-0.08949456,-0.15140341,0.47851908,0.26136625,-0.07496417,0.58721054,0.70243484,0.5440602,-0.10828149,-0.36090165,0.3805251,0.28339237,0.42895514,0.65163445,-0.44502732,-0.29930416,-0.6873055,0.42184603,0.41130748,-0.14492992,0.124565706,-0.72801745,-0.60463667,-0.036395404,-0.85734123,-0.22443883,-0.3056936,0.7635317,0.06330578,-0.2853762,0.12334018,0.3309494,0.87917656,0.89211553,0.3007736,-0.97463727,0.29724023,0.999109,-0.66771996,-0.3195397,-0.97956795,-0.4129397,-0.6226807,0.16430017,0.40848657,-0.030469269,-0.0777848,0.027111063,-0.8902199,0.012879181,0.55653256,-0.8413046,0.47129846,-0.33655757,-0.4005535,-0.9999332,1,0.86175984,-0.67860115,0.7739425,-0.5556458,0.4590644,-0.87661827,-0.6341255,-0.51446205,0.2924962,0.36525574,-0.81669503,-0.6674277,-0.30740723,0.08623747,-0.15806781,-0.4073217,0.43467098,0.9824541,-0.99903744,-0.78570217,-0.39576858,0.6422422,-0.36974266,0.18658717,-0.9845756,-0.5411966,0.10884257,-0.005235082,-0.38434362,0.40685523,-0.2710065,0.99396783,-0.48754835,0.87852865,-0.09420973,0.7420519,0.09453417,-0.89581424,-0.4575468,-0.23966232,-0.19427985,-0.74055743,0.5655914,0.56610024,0.34471226,-0.2317812,-0.41767487,-0.74747336,0.3255409,0.6774227,-0.3273754,0.2879535,0.26713133,0.99967676,-0.63054246,-0.50217193,-0.57516384,-0.2415248,-0.036504507,0.9999276,0.34909698,-0.21141432,-0.4127544,-0.29665408,0.079630084,-0.08803437,-0.997404,0.40773547,0.36626577,0.46156052,-0.122715734,0.4630184],
    [33,1,"NC(=O)n1c(O)c(C(=O)c2cc(Cl)cs2)c2cc(F)c(Cl)cc21",0.46226048,0.18618827,0.4527189,-0.23132792,0.09548863,-0.0954415,0.10545929,-0.4705802,0.24416545,0.032623697,0.29047918,-0.6927417,0.2585211,-0.54304713,0.77509785,-0.20119107,-0.35009488,-0.53339624,-0.4760545,0.00229974,0.7678353,0.02630933,0.39508042,-0.009645002,0.32931817,0.75878036,0.7478121,-0.43613338,0.35781682,0.63101685,0.4909443,0.19317898,-0.4949463,0.36903122,-0.2352529,-0.57800627,-0.3412099,0.102167144,0.9993858,-0.5211516,-0.3274473,0.53723305,0.37057683,0.43000376,0.2947862,-0.26291677,-0.114241764,-0.2925092,0.5879278,-0.002605033,-0.012847491,0.47630462,-0.101863734,0.7299531,-0.778143,0.24939452,-0.7852146,-0.7845028,0.081453204,0.44468656,0.56019485,-0.002771425,0.080724515,0.42454556,0.2587132,0.64235926,0.56134206,-0.35065943,0.50670666,0.22382323,-0.94067544,-0.88643855,-0.100820236,-0.8154746,0.60511404,-0.17284474,0.41696054,-0.6685653,-0.70394623,-0.9983603,-0.613813,-0.111781605,-0.90248984,0.0514669,-0.17024648,-0.7062809,0.47864655,0.2608676,-0.4327003,0.015928423,-0.116190456,0.18962,0.21261567,-0.17613989,0.9983337,0.018129053,0.1644004,-0.1776973,0.10163723,0.047362972,-0.16751055,-0.37256476,0.4160832,0.37909195,-0.99587613,-0.78289104,0.7571051,-0.489282,-0.99989176,0.4911183,-0.7763047,0.03330552,-0.7470361,-0.20121059,0.1798399,0.34776512,-0.6167715,0.36222553,0.9916286,-0.42167035,-0.7302559,0.81214,-0.59910697,-0.3083063,-0.7795827,-0.099566534,0.6305444,0.3846077,0.023066873,0.9991365,0.69883674,-0.66042805,0.43552947,-0.35240215,-0.34564874,-0.68468404,0.71716857,0.16444056,-0.246894,-0.7777239,-0.99999696,0.46926287,0.47941738,0.4966087,-0.19680768,-0.3234751,-0.5958284,-0.14883362,-0.9307213,-0.8220261,-0.34671536,-0.67545736,0.1515946,-0.036266983,-0.510982,-0.55171335,0.24425088,-0.2454332,-0.8104406,0.2576253,-0.73198175,0.13114351,-0.81875,-0.673808,-0.2155794,0.00999934,-0.29985535,-0.69204265,0.010265229,-0.1510219,-0.20610845,0.8394664,0.19153218,-0.17727084,0.6985708,-0.2526326,-0.7600174,0.033153985,0.5389419,0.35936362,0.22061424,-0.9507548,0.6198151,0.4249585,0.5656879,0.45398688,0.52250504,-0.011479922,-0.43543416,-0.77998763,0.18146566,0.23221569,-0.041707158,0.23558934,-0.44393453,-0.6075608,0.3767543,0.37684563,0.118365414,0.5985181,-0.59887576,-0.24872132,-0.69466496,-0.56371945,-0.18008898,-0.7080381,0.6979567,0.6837353,0.5248382,-0.999856,0.75307137,0.020826362,-0.3037688,-0.37164098,-0.80770415,0.030905835,0.56519014,-0.1103562,-0.53267354,0.011162286,-0.096312955,-0.39868063,-0.67093223,0.56993836,0.99997026,-0.45544714,-0.3527675,0.56332594,-0.14547858,-0.26622856,-0.759347,-0.5741713,0.5728716,-0.22442386,0.5058326,0.08211002,-0.07263547,0.11100556,-0.18974978,0.17535292,0.63208133,0.61455524,0.87923557,-0.6342955,0.4407239,-0.34427297,0.32297313,-0.6034588,0.15159953,-0.6159683,0.24201001,-0.70404565,0.1373801,-0.07067598,-0.30638418,-0.79143023,-0.19492672,0.4001913,-0.20048948,0.58156735,-0.19988586,-0.450807,0.67199767,-0.08385924,-0.55595124,-0.92218316,0.54195565,0.44971156,0.1932824,-0.084385246,0.47234398,0.99695766,0.45786604,0.5529207,0.18766083,0.7465358,0.088429675,0.12056058,-0.017377347,-0.3754353,0.51708573,0.9965586,0.6040093,-0.2825589,-0.16420487,-0.25676695,-0.5612426,-0.0727888,-0.9534822,0.17667143,0.18231335,0.8836572,-0.18922585,0.8107822,-0.4224141,-0.37192413,0.9999995,-0.96285397,-0.55761814,0.19081573,-0.066576794,-0.03617537,-0.4694077,0.33127066,0.53237396,-0.59758604,-0.95445424,-0.275936,0.10722809,0.19367425,0.349445,-0.33101034,0.69544756,-0.5851912,-0.39544067,-0.37445116,0.003790394,-0.5264797,0.9668685,0.084175356,0.44866392,0.14686736,0.15412739,-0.8335715,0.45995393,0.056637395,0.22061941,-0.8503827,0.25302985,-0.06941277,-0.6803931,0.11345505,-0.5041498,0.70533836,0.20522958,0.25572994,-0.327387,-0.45881632,-0.32105646,-0.61784136,0.15646231,-0.074901976,-0.50609595,-0.09532772,-0.6903086,-0.6581713,-0.19737601,-0.29550683,0.24719465,-0.8697262,-0.88014585,-0.77395767,0.45455602,-0.19111733,0.16585436,0.24361376,-0.37910593,0.99962777,0.026131181,0.365159,-0.6572853,0.50670046,-0.14899053,0.6761237,-0.8886173,-0.07999999,0.30985096,0.5771796,0.7690597,-0.2753407,-0.60240436,0.78881574,0.82661986,-0.53907114,0.5329094,-0.99790347,0.73294157,0.020515062,0.20715387,-0.08523634,-0.68768847,-0.099598706,-0.8063064,-0.6889828,0.061650146,0.4545014,-0.33745885,0.5540029,0.05988915,0.8818363,0.22189777,0.20551746,-0.21039464,-0.053285077,0.5585799,-0.41325754,-0.101867646,-0.059665244,0.72669923,0.04597883,0.8022703,-0.20594546,-0.017352367,0.74828005,-0.31113595,0.38456059,-0.29406792,-0.5674854,-0.23476456,-0.63529557,0.38985294,-0.07741824,0.34886166,0.37218255,0.5896508,0.8358341,0.9101163,0.0896541,-0.946506,0.5466954,0.99983716,-0.83076435,-0.6040746,-0.982308,-0.44286677,0.07372577,0.7770476,-0.5412773,-0.6079037,-0.6632401,0.24747543,-0.44105944,0.09479287,0.2801249,-0.92463195,0.13945623,0.25483304,0.27846995,-0.99999493,1,-0.4672168,-0.57814497,0.035835825,-0.43351674,0.32538843,-0.38499564,-0.85930884,0.19589032,-0.74652886,0.5642886,-0.7617317,0.026709707,-0.55336314,-0.017148456,-0.28202215,0.66061765,0.55622816,0.6937261,-0.99989307,-0.28363395,-0.0927461,0.00888405,-0.039485905,0.31486803,-0.36046404,0.28086966,-0.27698448,-0.10673951,-0.14855325,0.6190806,0.2381448,0.9815958,-0.30829078,0.6018914,0.07178803,-0.4445652,-0.85493886,-0.3446811,-0.15891267,0.4872196,-0.5793237,-0.005196675,-0.8858066,0.56367725,-0.5856929,-0.25348788,0.65337497,-0.45389777,0.45745653,0.63866276,-0.5389018,0.18358432,-0.15510198,0.99436647,0.20116282,0.22383186,-0.6388617,0.27011958,0.35650524,0.999867,0.13249676,-0.42803928,-0.28957406,0.7878809,0.6931138,-0.19281198,-0.9943634,-0.77827215,0.6604161,0.74683994,0.05876015,0.3417632],
    [34,1,"CC(C)(c1ccccc1)c1ccc(O)c(C(C)(C)c2ccccc2)c1",-0.7327451,-0.39397618,0.17601089,0.3518876,0.75866425,-0.5397493,-0.6868821,-0.5016337,0.39421156,-0.40596387,-0.8183577,0.36717737,0.038643736,-0.47291324,-0.48048082,-0.1793103,-0.10131749,0.31798622,0.17773284,0.5191059,-0.39299822,-0.52528775,0.76785874,-0.061893433,0.07753212,0.77034533,0.09900376,0.4622819,0.84284645,0.14084016,-0.744033,0.1976634,-0.0211639,0.048802268,-0.23750393,0.5400209,0.30891603,0.66411316,0.9992218,-0.8059475,-0.73157173,-0.2963805,-0.5708909,-0.52351946,0.22907642,-0.294472,0.013645704,0.33766314,0.97305846,-0.3305929,0.7183403,0.3326013,-0.17415312,-0.38462645,-0.9187704,-0.14839754,-0.73356,-0.7112484,0.10939101,-0.23328218,-0.106133,-0.6091071,0.63664037,0.044483848,0.04722196,0.11629483,-0.11107366,0.46563825,0.15800647,0.7295249,0.39669326,0.6693801,0.15704717,-0.2325374,0.92332983,-0.2063903,0.15737127,-0.219605,0.07690196,-0.9957381,-0.61376023,0.3904032,-0.78893346,-0.39755663,-0.1855245,-0.9915325,-0.6515852,-0.10743116,-0.31081107,-0.081562325,0.68773913,0.015137337,-0.20536889,-0.64833564,0.5093632,-0.1926973,0.9276562,0.11684976,0.36533865,-0.38582352,-0.11466939,0.5351506,0.19229887,0.9261541,-0.9977162,0.73716664,-0.12075561,0.25623432,-0.8784974,-0.5343247,-0.30299997,-0.22631453,-0.057589613,-0.2984373,-0.29222706,0.5013948,0.38161874,-0.14774725,0.9693986,0.052371986,0.6419676,-0.6098952,-0.26951542,0.1409415,-0.44438747,-0.40870038,-0.4539879,-0.5556059,-0.27921292,0.9999921,-0.63656104,0.36395794,0.5778809,0.10068138,0.28213054,-0.9073285,0.6468703,0.937235,-0.800596,-0.6153368,-0.9999985,0.5205503,0.97872764,0.7316548,-0.12992963,0.027050018,0.34485993,0.345119,-0.9635972,0.17911945,-0.13069476,-0.821044,0.6019792,0.30122134,-0.22309613,0.024379235,-0.37934873,-0.59974134,-0.86136115,-0.5558252,-0.55007845,0.20469253,-0.3467691,0.34090298,0.4331798,-0.25872645,0.8502684,0.067011796,-0.11571279,0.60415226,-0.66237646,-0.4416552,0.5444176,0.6550713,-0.5181842,-0.9756481,-0.82454437,0.7423618,-0.08197162,-0.34054342,-0.046414617,0.839892,-0.17023416,0.504879,0.4513995,-0.11525291,0.055534303,-0.5002063,0.14194508,-0.4048456,0.021090303,0.38136065,0.29235938,0.8879599,0.37584502,-0.5278731,0.4041863,-0.60843354,0.77786773,-0.09292231,-0.026032167,-0.037912153,0.3841441,0.16736667,0.5170075,-0.68657285,0.537929,-0.42958796,0.48965016,-0.9998919,-0.17349073,0.2105328,0.6452542,0.17386764,0.7845051,0.13663314,0.06532002,0.19743724,-0.00860923,0.5534851,-0.079105884,-0.12217226,-0.56327504,-0.8041432,0.98630625,-0.3501757,0.6353009,-0.31721783,0.11494124,0.41729027,-0.12570865,0.025464345,0.61499697,-0.087584674,0.36094213,-0.6432075,-0.17179392,0.23300019,-0.5499105,0.08576155,0.8349999,0.7251505,0.04894952,-0.27552965,0.47445145,0.21875933,-0.04583929,0.56634617,-0.07690513,0.105930015,0.054299057,-0.7815692,-0.502716,0.71885765,0.44346246,-0.121693216,-0.7048881,0.1439222,0.41498196,-0.11166937,-0.47762525,0.61271054,-0.5663869,-0.68240523,0.49849528,-0.35846853,0.49921954,0.2219838,0.26257324,0.10389958,-0.78545547,0.98295236,0.31698367,0.19543666,-0.064038634,-0.14854784,0.1785055,-0.73149246,-0.17778488,-0.59935755,0.7154868,0.9955014,0.28573385,-0.026286174,-0.39330953,0.11047565,-0.30002463,0.924239,0.12766343,-0.7276518,0.094045445,0.70725393,0.36913347,0.2651305,-0.28401703,-0.4150817,0.99999964,-0.9996341,0.541734,-0.07578743,-0.12048131,-0.4778823,-0.56878513,-0.5522374,-0.53542316,-0.97065383,-0.9810704,-0.1884143,0.74176836,0.111000426,0.16923223,-0.6013673,0.12694232,0.054551072,0.9532521,-0.76605624,-0.36186415,-0.3149167,-0.9275626,0.623677,-0.07805946,0.57359457,0.47049475,-0.63157886,-0.7363625,-0.6512768,0.47838393,-0.97612214,-0.21182063,0.3654866,0.39821267,-0.16514853,0.5396654,-0.64855087,-0.38950652,0.9890557,-0.19521318,0.14322531,-0.043055717,0.018257063,-0.6303914,0.14736173,0.54159516,-0.043559927,-0.121416345,-0.7791964,-0.2312761,-0.23156773,-0.53574663,-0.8813085,-0.9106772,0.021851188,-0.74439704,0.03888182,0.2432299,-0.62206924,0.21334444,0.9997672,0.5863107,-0.39224243,0.2926232,0.16437386,-0.37838095,-0.20363842,-0.97470325,0.07179044,-0.31913784,-0.030964678,0.35515735,0.087034315,0.23679686,0.023189785,0.5218027,0.3254407,0.000650598,-0.9909591,0.44540927,-0.45976588,-0.19462192,0.061741497,-0.40924168,-0.1378965,-0.63548416,-0.6295919,-0.0522488,-0.0616146,0.49770257,0.43413275,0.2872953,0.5614467,0.465463,0.12222025,-0.26272866,0.2901382,0.52590245,-0.23833744,-0.8481988,-0.84663963,0.5622638,-0.78964007,-0.86137575,0.85753685,-0.18428913,0.20834282,-0.16658963,-0.6524018,-0.35394034,-0.82283807,-0.19378726,0.10975935,0.5834679,0.20699158,-0.45358714,0.002513094,-0.4898858,0.43308935,0.9998754,0.15439504,-0.98630375,-0.1666091,0.99931836,-0.38238162,0.26531142,-0.9991777,0.16419521,-0.1206184,0.47356266,0.00626355,-0.5526933,0.7504357,-0.55546385,-0.9510122,-0.8258371,0.15593976,-0.6050092,-0.18795279,0.3325149,-0.068809606,-0.99997073,0.9999997,0.06893192,-0.31554574,-0.08348733,-0.30118334,0.004939646,-0.79729533,-0.38671497,0.13358444,-0.5058703,-0.4740294,-0.890363,-0.5600034,0.62681973,-0.16421846,0.45150918,-0.27120695,-0.67340416,0.86697435,-0.99980223,-0.44938728,-0.23994139,-0.49242792,0.044280734,0.004347655,-0.9980615,0.38743436,-0.39427274,-0.4011401,-0.5210236,0.32116833,-0.1800972,0.98657775,-0.5884882,-0.08382967,0.6207439,0.29041818,0.16060027,-0.8245611,0.20229173,0.1986497,-0.035882823,-0.87689275,-0.97113127,-0.055377003,0.3480387,-0.7457826,0.37493977,-0.30549824,-0.2826896,0.5535084,0.05455223,-0.63651705,-0.03490323,0.9972516,0.20797807,-0.06317989,0.27755368,0.26029536,0.13458762,0.9995192,0.7581591,-0.004487714,0.27759135,-0.041813284,-0.02781199,0.1103507,-0.99561805,0.14075865,0.5803485,0.60633034,0.8020263,-0.35562345],
    [35,0,"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F",-0.7881616,0.36123216,-0.9526886,-0.35908753,0.56746715,-0.8222381,-0.24191627,-0.081232436,0.2253497,-0.5763282,0.19427386,0.42879334,-0.38485336,0.89131296,0.2228264,-0.99695563,-0.62793714,0.6005173,-0.07263416,-0.72039586,-0.6994126,0.13492694,0.74015033,-0.6823283,0.7811678,0.66302913,0.46662423,0.3530404,0.97643083,-0.037398595,-0.6018599,0.82884973,0.32092965,0.16807912,0.25541037,0.86175245,0.010616149,0.5164059,0.9997755,0.60044116,-0.3219703,-0.26016742,0.2474861,-0.59155136,-0.2034691,0.5347661,0.75609994,0.5077087,0.9779487,-0.4687575,-0.21053508,0.38807148,-0.16210884,-0.56869614,-0.67199546,-0.5045504,-0.855615,-0.98790044,-0.8626226,-0.26511213,0.27058345,0.04275432,0.4381013,-0.3396763,0.04995399,0.51713765,0.022379678,-0.6242807,-0.24625337,0.46670207,-0.7759432,0.21166174,-0.36353716,0.82887787,0.7209856,-0.79394686,0.79908276,-0.58552456,-0.7667801,-0.9962418,0.19989163,0.6307444,-0.66523117,-0.16984014,0.58779913,-0.81757385,0.3029099,0.24896923,0.40655887,0.63929677,0.56932247,0.78339255,0.53281766,0.36350316,0.98577553,-0.43530226,0.533326,-0.03818996,-0.37181443,0.6842626,-0.39765432,-0.33929422,-0.13779268,-0.44145706,-0.9996276,0.64181995,-0.025086336,0.26883826,-0.73850286,-0.49133217,-0.5091718,-0.28406498,-0.8766329,-0.79425997,0.54181916,0.8651028,0.1754772,0.84708965,0.959087,-0.8021338,0.8041111,0.023649042,-0.1674912,-0.19299093,0.24181081,0.4403918,-0.5782696,-0.074129276,0.19716085,0.9997902,-0.40035555,-0.4632804,0.90815926,-0.66019416,-0.32875267,-0.8905427,0.49344072,0.5700443,-0.8925338,-0.73453015,0.9995081,-0.40596727,0.8688843,-0.22250722,0.4573604,0.38722962,0.79754287,0.012409781,-0.9960093,-0.22768761,-0.44609037,-0.49135658,-0.042999566,-0.6587372,-0.81985503,-0.4509163,0.2677944,-0.9467093,-0.97698104,-0.40732694,0.36868086,-0.373149,-0.68459123,-0.13492031,0.5707068,0.14991657,-0.7688254,0.5695274,-0.39864352,-0.2706512,-0.91145283,-0.9206919,-0.36161,0.87135243,-0.40066394,-0.945954,-0.88827294,0.6548566,0.34122694,0.6913099,-0.7916849,-0.42452592,-0.5970263,-0.95738316,0.9440328,-0.7673664,0.43107083,0.7260007,-0.57358736,-0.957055,-0.03438646,0.76586515,0.70164406,0.042141538,0.028630419,0.10333795,0.51258415,-0.5650644,-0.115017936,-0.5972868,-0.80881673,0.55770445,-0.4113201,-0.7493853,0.61215734,-0.1851423,0.5802929,0.71058315,-0.751468,-0.9999096,-0.41955674,0.8332606,0.7521177,0.18735747,-0.92175126,0.44845456,-0.20538375,-0.15535241,-0.23968275,0.33205122,-0.22544017,-0.17892219,-0.25298592,-0.06565106,0.9586887,-0.27377725,0.5849009,-0.13249093,-0.08831545,-0.83432466,-0.621216,-0.20158184,-0.09633959,0.11540643,-0.677415,0.5845346,-0.41309232,0.46815965,0.026119772,-0.0883488,0.5095933,0.92675424,0.8123401,-0.02474257,-0.9862743,0.18404174,-0.23820469,-0.111360215,-0.83008033,-0.1510946,0.74381363,-0.9997289,-0.86416954,0.03222539,0.17243622,-0.7273778,-0.47084543,-0.33492303,-0.41411754,0.4285948,-0.3363457,0.41538784,0.109833725,-0.64140797,0.5826104,-0.7929359,0.5354882,0.15104868,0.95935684,0.48887235,-0.8936835,0.99101216,0.75367767,0.5898139,-0.43245554,0.89574534,0.10043692,-0.9114289,0.22182353,-0.9941921,-0.5306231,0.9451065,-0.03102741,0.25930008,0.34197986,0.48531798,-0.85864896,0.7849498,-0.75955075,-0.9383912,-0.6938081,0.1273624,-0.79616326,0.60577667,0.45170018,-0.53416747,-0.9960011,-0.9971647,-0.032145765,-0.14735267,0.34390646,-0.67057467,-0.5065983,0.70816004,-0.572104,-0.12408841,-0.99568427,0.28311175,-0.09969608,0.04709714,0.5385547,-0.40395945,-0.010045622,0.5672739,0.6195193,0.79406685,-0.5672673,0.20077598,-0.9391983,-0.328554,0.20149484,0.7492049,0.85894245,0.5009355,-0.48702654,0.84223664,-0.016873924,-0.9720795,-0.91526806,-0.47435653,-0.7733808,0.21268006,-0.49366543,-0.10504449,-0.034578566,0.9686781,-0.86655563,-0.6159444,-0.21064863,0.2747791,-0.73866236,0.44574338,0.8620191,-0.92909336,-0.11846446,-0.72223216,-0.002807297,0.36427784,0.59720516,-0.93528473,-0.045279767,-0.30852565,0.77799517,-0.16796279,0.26400003,-0.30822268,-0.4310681,0.99991304,-0.28676724,-0.5950389,0.3765773,0.6686788,0.01511858,-0.4698353,-0.9383031,-0.1637382,0.76143295,0.91056484,0.44089645,-0.21671918,-0.24766257,0.12869383,0.9045315,-0.058408774,0.38114336,1,0.4967559,-0.7406481,0.03394914,-0.532247,-0.8667288,-0.16653198,-0.8324014,0.32893786,-0.27789566,-0.42689258,-0.49288264,0.8348833,0.66811615,0.63868505,-0.045319304,-0.37273443,0.4347748,0.43920517,0.37329295,-0.99923366,-0.771822,-0.625581,0.8034312,-0.49195346,0.43213883,-0.34739104,0.025369864,-0.21737689,-0.13908707,-0.42155525,-0.03552975,0.2512376,-0.53274804,-0.14456677,0.7561236,0.08183477,-0.10341065,0.6579668,0.7110023,0.8083922,0.99985147,0.29226974,-0.993386,0.13386571,0.9983037,-0.97336346,-0.3696426,-0.99893844,-0.38796076,0.296929,0.1897424,0.16142748,-0.32438326,-0.38089198,0.4752126,-0.94598067,0.08669533,-0.46344814,-0.64285904,-0.3894671,-0.33244708,0.023758447,-0.9999552,-0.9999999,-0.33204275,0.36650681,0.3418987,-0.36045033,0.53933525,-0.76236504,-0.48428744,-0.39797664,-0.83019334,0.8421956,-0.72220355,0.1827804,0.18366216,0.3227358,0.29662248,0.4474249,-0.7129372,0.9163305,-0.9993568,0.6652409,0.6288689,0.3720825,-0.1291815,0.09555465,-0.9169651,0.20696238,-0.36913827,0.20965023,0.5068304,-0.0681997,0.43175226,-0.9530596,-0.3659138,-0.254596,-0.33574387,-0.79540884,-0.63517267,0.41804844,-0.56926924,0.08155095,-0.8000596,-0.8139736,-0.9989522,0.20067829,-0.32964146,-0.11054573,-0.1592647,0.36399105,-0.22471249,0.9069051,-0.76386327,0.22462615,0.46697932,0.99884844,-0.36421573,0.8487445,-0.18172263,0.36008915,0.4233039,0.99071926,0.90667874,-0.8017944,-0.26592395,-0.4512542,-0.7614481,0.89200175,-0.99865484,-0.010859129,0.4866773,0.9807764,0.87241393,0.08842652],
    [36,1,"CC(C)(C)C(O)(CCc1ccc(Cl)cc1)Cn1cncn1",-0.49319994,-0.73742884,0.3130477,0.017369973,0.54463637,-0.560457,-0.56321245,0.23760223,-0.067217074,-0.4910428,-0.61211246,0.10114882,-0.14547154,-0.599731,-0.051565707,-0.4674991,0.37087524,-0.23715198,0.42882064,-0.113686256,0.08779425,-0.55516046,-0.5249407,-0.54474604,-0.37359643,0.119826876,0.20052715,0.70929134,0.65217805,-0.028541405,0.34093374,-0.26921627,0.8329206,0.80169487,-0.42409888,0.71824944,0.2931783,0.09401404,0.9936452,-0.7612476,-0.43416128,0.4860369,0.57283455,-0.26469105,-0.19686453,-0.6878657,0.5220525,0.5941438,0.8572717,-0.2607964,0.6657308,-0.1595357,0.46403834,0.35201493,-0.800016,-0.5535654,0.25569612,0.13328858,0.25211462,0.11565068,0.088951185,0.038973086,-0.015338319,0.23029351,0.1780515,0.14877059,0.80006236,0.5548734,-0.5338517,0.5796482,-0.68172747,-0.87612486,-0.077049814,0.37953475,-0.15291347,-0.35212597,0.80215615,-0.16234776,-0.48966545,-0.9994492,0.42310295,0.4485591,-0.8537513,-0.33003086,0.35530162,-0.8915026,0.25238344,-0.5369846,-0.33862713,-0.23851264,0.28788492,0.50818133,0.47487482,-0.093823135,0.9825772,-0.007519274,0.24409004,0.25204557,0.3707512,-0.2390343,0.44546834,-0.36454588,-0.17251742,0.9787742,-0.9696018,-0.72799087,0.23740222,0.57509947,-0.7848513,-0.49988294,0.5117049,0.13503967,-0.44378605,-0.46384177,-0.62081283,0.82316875,0.02078834,-0.15234876,0.9923537,0.5039204,-0.47656465,-0.11779538,0.080733955,-0.004075886,-0.22563986,-0.81285095,-0.04271585,-0.746071,-0.111240946,0.99977195,0.25009814,-0.19383997,0.40438497,-0.1410743,0.5531248,-0.93219864,-0.060326215,0.6739569,-0.04195117,-0.16282557,-0.999989,-0.0702244,0.9251345,-0.31169012,0.36269668,0.24861743,0.26756018,0.23556612,-0.5595074,-0.41794693,0.001253228,-0.89525115,0.47912344,0.32901344,0.33431092,-0.4343668,0.48417208,0.6812136,-0.6470019,-0.26893607,-0.9029362,0.16483948,-0.033867728,-0.42140177,0.2739892,-0.31860223,0.038169038,0.5389294,0.3231988,-0.41640088,-0.09917824,0.70767784,-0.43002787,0.2709259,-0.40581843,-0.7575979,-0.5915732,0.47980523,-0.29755104,0.4762807,0.24084638,-0.3707973,0.6438213,0.5653672,0.5217617,0.44844958,0.48539364,0.47412023,0.40500838,-0.21343172,-0.58147234,-0.7517592,-0.7685261,0.4899299,0.012057888,-0.19436845,0.4983112,-0.48177278,-0.21942802,0.053094935,0.014025126,-0.23615628,0.48893446,-0.49400106,-0.036681477,0.030564528,0.21712513,-0.3150489,-0.34278283,-0.999733,-0.30276677,0.6301412,0.21163025,-0.012695107,0.15306075,0.6645975,-0.5342149,0.4367608,0.1688762,-0.035444066,-0.18824579,-0.8211797,0.71302867,-0.7559565,0.97911143,-0.23040064,-0.49593207,-0.32487348,-0.06940798,0.5523734,-0.006994753,0.030154362,0.65407485,0.5496131,0.3056169,-0.36097443,0.7191712,-0.67112756,-0.012284366,-0.414616,0.8982796,0.7188384,0.6356041,-0.43965307,0.28352508,-0.15517989,-0.59170103,0.010382216,0.06708378,0.17473115,-0.27274343,-0.97334766,0.60561454,0.32253087,0.011598823,-0.61692005,-0.10300115,-0.11605094,0.7808082,-0.16526471,0.24912806,0.44680035,-0.4548931,-0.42576498,0.026788982,0.51506054,-0.27758944,0.30844572,0.3701939,-0.52366805,-0.59665626,0.9904772,-0.44027004,0.77288026,-0.5717498,0.19084384,0.39999875,-0.7759581,0.17687559,-0.74537903,0.7028138,0.99814016,0.19116029,0.14245409,-0.00628808,0.35500407,0.33743793,0.67308056,0.46688172,-0.6628571,0.07149153,0.9773125,0.30570018,0.051051527,0.50625944,-0.40218702,0.9999871,-0.9870435,0.016363448,-0.008152925,-0.11380286,0.16069981,-0.51041406,-0.123835266,0.8551931,-0.13691308,-0.73896664,-0.070426814,0.7261134,0.4648206,0.3777553,0.05142064,-0.47950134,-0.14363047,0.7088725,-0.3888005,0.30004424,-0.04657223,-0.966415,0.21365136,-0.67067224,-0.5907836,-0.315434,-0.12737943,0.13664919,0.23834218,0.21876182,-0.73063403,-0.2521411,-0.06722101,-0.36566588,0.63530236,-0.36217353,0.26263005,0.07365159,0.5977392,0.37587434,0.6105921,-0.21698588,0.114457645,-0.5174388,-0.62188816,0.70239276,0.22360443,-0.02495939,0.06049653,-0.7398153,0.23949182,-0.5021975,-0.5110006,-0.9547297,-0.6843049,0.10510967,-0.2620474,-0.35300738,-0.26809123,-0.14269865,0.9992768,-0.7102448,0.058096714,-0.2835354,-0.16735744,-0.81388575,0.7623234,-0.55522484,-0.56606287,0.625642,-0.251606,0.5208196,0.18988915,0.31229475,0.16024739,6.22e-05,-0.3971491,0.11800061,0.99251896,0.43123266,-0.7547111,0.028894909,-0.010241064,-0.076335676,-0.16691568,-0.04528973,-0.37569138,0.018548815,-0.056706447,0.000298975,0.33602396,-0.40514594,0.38022402,-0.20199096,0.38326803,0.264567,0.15502428,0.39006048,-0.6236632,-0.61498755,-0.13703343,-0.2912906,-0.3027417,-0.27604505,0.13282812,-0.32770926,0.20024656,0.08168023,-0.09756853,-0.8228852,-0.24672483,-0.8670737,0.5535924,0.25437516,0.3289317,0.43697792,0.33175117,-0.2623922,0.09485473,0.999943,-0.23026986,-0.952514,-0.8467661,0.9991973,-0.7557745,0.3964744,-0.99888504,-0.42957178,-0.36957416,-0.81319666,-0.6424921,-0.58288026,-0.049944405,0.5214785,-0.34518114,-0.6115388,-0.24236488,-0.2983157,-0.65723264,-0.121156305,-0.6045895,-0.99994737,0.99570614,-0.6055696,-0.6177245,-0.28685257,0.04561244,0.69396937,-0.33903596,0.05442772,-0.20681727,-0.6309369,0.63767004,-0.16420425,-0.48741603,-0.59502035,-0.08578327,-0.625841,0.6792728,-0.39391983,0.20997909,-0.9998362,-0.19694522,-0.3792531,0.074837774,0.0979435,-0.6046266,-0.92721766,-0.09371464,-0.5028171,0.37345475,0.28576708,-0.35993114,0.5588959,0.9699298,0.0563312,0.55767494,-0.3223852,-0.35041103,0.43161324,-0.5616163,-0.30702817,-0.6216725,0.437317,-0.37950465,-0.7571283,-0.42379162,0.0584849,0.055775918,0.75306785,-0.53860813,0.49521434,0.25571194,-0.4589812,0.07824941,-0.24915802,0.98395777,0.27045977,0.45699152,0.16835962,-0.1636803,0.23192339,0.99997586,0.5988376,-0.65406656,0.2979071,0.32355857,0.38742834,0.16646908,-0.993006,-0.36932978,0.29503676,0.24718249,-0.2286967,-0.096097365],
    [37,1,"CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)cc1",-0.8279889,-0.38492572,0.7823869,0.09287199,-0.45261973,-0.57988584,-0.7589154,-0.12922938,0.16243389,-0.3611168,-0.39611173,-0.16728407,0.25949198,-0.5917924,-0.21804243,-0.17533675,-0.42330655,-0.48806652,0.5815322,0.38230404,0.37445918,-0.018152319,-0.46713254,-0.5892729,-0.00443051,0.66882056,0.21890198,-0.5806591,0.3234386,-0.12309258,0.0952614,-0.10618721,0.51366204,0.27551955,0.27011707,0.45901835,-0.22073999,0.671763,0.9994286,-0.5791854,-0.80176425,0.079993784,0.030821662,-0.3989958,-0.21084182,0.18874589,-0.49245822,-0.2986905,-0.48256072,-0.14933828,0.77233547,-0.3829161,-0.37815803,0.4909195,0.057702452,-0.05972827,-0.27951714,-0.7557604,0.2143883,0.040279076,0.16655494,-0.23988667,0.6039658,0.2326633,-0.38249648,-0.21937412,0.45828065,-0.09003942,0.016737731,-0.033999052,-0.9544257,-0.90554065,-0.48240167,-0.66956013,0.5501728,-0.0097205,-0.31154895,-0.29272845,-0.3838311,-0.99899876,-0.27148592,0.2181193,-0.92036784,-0.12179256,-0.232263,-0.95099354,0.2678428,-0.085362166,-0.05671594,0.23269026,0.40234914,-0.25072014,-0.16042295,0.13330029,0.99722445,-0.2727663,0.774863,-0.42616916,-0.27337366,-0.064903535,-0.02028573,-0.3323799,-0.5493232,0.9912983,-0.9985059,-0.5838893,-0.08110713,-0.051744156,-0.9996179,-0.17315552,0.06103222,0.42771444,0.01856556,-0.009032294,0.23041712,0.3307409,-0.39418134,0.3271985,0.9119043,0.23035361,-0.10933854,-0.20106414,-0.38008654,0.27228212,-0.13131738,-0.131684,0.151767,-0.70268536,0.17738381,0.9997568,0.23955192,0.21213327,0.274624,-0.1260766,-0.27111512,-0.9612772,-0.20526293,0.64110637,-0.7142025,0.50979114,-0.99999386,-0.30867258,0.5303414,0.46386737,-0.34297183,-0.3149325,-0.13668747,-0.46501264,-0.983226,0.203217,0.12160636,0.6925748,0.06062165,0.6320675,-0.07320919,0.31515247,-0.031341143,-0.73306876,-0.7810832,0.8434254,-0.29950267,0.38866934,-0.291353,0.3459735,0.61320925,-0.38354698,0.16142271,0.6433805,-0.22710578,-0.095042855,0.24346481,-0.113488175,0.09698145,-0.2712703,0.009185244,-0.9422329,-0.41018134,-0.1973216,-0.35482818,0.10321487,-0.11643048,-0.64778215,0.06414315,0.13502926,0.38143355,-0.07931684,0.40493515,0.08724245,0.3341945,-0.24226102,-0.39205715,0.0881218,-0.38739893,0.7035294,0.3833775,-0.033572093,0.4464522,-0.7254608,0.6130784,-0.368179,-0.33628106,-0.52246773,0.30315548,-0.31157959,0.36846712,-0.1354459,0.2253735,-0.4510953,-0.11212079,-0.9998876,0.6703246,-0.12039832,-0.4731993,0.10500391,-0.063270256,0.21192285,0.25177068,0.019237874,-0.35807306,-0.020471584,0.30001384,-0.25938576,-0.45331338,-0.27247518,0.9083487,0.15230915,-0.21958026,0.6121197,-0.17351899,0.3127514,-0.19442192,-0.2662242,0.43576664,-0.2855464,0.6174479,-0.025074687,-0.3649632,-0.036389098,-0.3399277,0.5330295,0.856389,-0.22643113,0.08566943,-0.62927973,0.78801394,0.014635202,0.3425856,0.6246235,0.12751654,-0.07785254,0.2795084,-0.71577793,-0.31587106,0.57028997,0.28602102,0.38151512,-0.7501809,0.26528198,0.3344501,0.2731628,-0.368075,0.22918378,-0.51106185,-0.7822834,0.25625575,0.3462603,-0.16075574,0.28580192,0.46671993,0.33042032,-0.37716788,0.9873289,0.06078844,-0.14740391,-0.6516651,-0.014428955,-0.3454966,0.002371463,0.26635376,0.18222713,-0.15565152,0.9900616,0.16033918,0.105100326,-0.2807,0.11731791,-0.32379457,-0.12523118,-0.98415583,0.3029227,0.057561014,0.4215937,0.071613885,-0.25119263,-0.11641437,-0.17365186,0.9999991,-0.98458475,0.7590985,-0.5730797,-0.022887312,-0.4908544,-0.7564779,-0.3703106,0.20767216,-0.12806794,-0.9961556,0.29869387,0.9220878,0.6175042,0.03230283,-0.02311862,-0.72701466,0.2594818,0.6126432,0.24394655,0.08917833,-0.44940996,0.95176804,-0.035079785,-0.25994286,0.18880017,0.45240796,-0.8054725,-0.14856133,0.49267298,0.47025487,-0.84571654,-0.48899287,-0.38871658,-0.41406542,0.50555766,-0.32022533,-0.029823566,0.5106684,0.33321533,0.25180474,0.054741286,-0.09321305,0.1773775,-0.394984,-0.29433453,0.20766902,0.6073062,0.23404703,-0.68473744,-0.10139065,0.30373803,-0.7244306,-0.9454117,-0.8375827,0.54706603,-0.3979643,-0.27142513,-0.14364478,0.21736766,0.38402236,0.99948186,0.42050004,-0.3507885,0.33026353,0.671124,-0.28468207,0.33725345,-0.8458047,0.39749575,-0.17038463,-0.6494531,0.4000785,-0.27328727,-0.061924223,0.7668906,-0.5077411,-0.1464097,0.26848224,-0.99571764,-0.09447883,-0.30586872,-0.707733,-0.08641683,0.40242773,-0.71216834,0.18352579,-0.19363828,-0.1553506,-0.3032489,0.660385,0.104723595,-0.12981918,0.4639562,-0.24174775,-0.07362488,-0.14805394,-0.0465294,0.056358572,0.17647995,-0.65915596,0.16348048,-0.82610184,-0.23136628,0.8108124,0.60430396,0.20430043,-0.1663819,0.22804815,-0.601705,-0.2202702,-0.7329901,-0.34601778,-0.5843469,-0.21113835,0.3052509,-0.3853497,0.7886861,-0.108102895,-0.20533441,0.9538763,0.36904854,-0.9750084,0.111645766,0.99964076,-0.48120877,-0.10227857,-0.989969,0.510091,-0.7899397,-0.24292378,0.09437071,-0.04417338,-0.022788007,0.052372966,-0.58395326,0.027235214,0.75973654,0.084656104,-0.2660556,-0.10275658,-0.18460727,-0.9999357,0.9999999,0.7757617,0.07232232,-0.14093766,-0.65525156,0.2902831,-0.5859004,-0.3002468,-0.19463715,-0.3297068,0.6054954,-0.8657902,0.056775816,-0.000248825,-0.28719327,0.28188798,0.3242135,0.1949352,0.9384424,-0.99936825,0.13229711,-0.48603794,-0.09628456,0.46509305,-0.43419665,-0.8892121,0.33391502,-0.7677162,0.46332553,-0.20719257,0.4573446,-0.20049737,0.9894718,-0.5765592,0.82015806,0.4751818,-0.2537482,0.24799708,-0.75312334,0.54814726,-0.6208365,0.12363771,-0.5329416,0.4563513,-0.09481052,0.18621573,-0.22073483,-0.13830593,0.113778435,-0.08530534,0.62329865,-0.21774645,-0.63332796,-0.26950726,0.9990559,0.61679703,-0.40753782,-0.009191391,0.4778378,0.42595035,0.9999655,0.39936653,0.578378,-0.027310185,-0.48549968,-0.63804305,-0.7555841,-0.99673927,0.06800562,0.140083,-0.37801868,0.5223025,-0.33117938],
    [38,0,"COP(=S)(OC)Oc1ccc([N+](=O)[O-])cc1",0.9221766,0.43933454,-0.6618421,-0.46974722,0.3493554,-0.5532184,-0.982971,0.10511442,-0.45648497,-0.016617993,0.37936553,0.48607948,-0.40199798,-0.27396107,-0.033750772,-0.058913633,-0.59735316,0.47222558,-0.53797466,0.2605551,0.622953,-0.04176196,-0.4982131,-0.028076854,-0.15641223,-0.07012289,0.19826251,0.27277517,-0.50913954,-0.14246954,0.1720168,-0.7041565,-0.6596502,0.101103604,0.5814685,-0.73014617,-0.3746668,0.18028785,0.97067404,-0.5650211,-0.98653096,-0.5568777,-0.3491312,0.045101598,-0.4211195,-0.94376504,-0.1902283,0.20958674,0.9936799,-0.08009849,0.58693594,-0.0777941,-0.54475486,0.44027802,-0.6309642,0.6904172,-0.6169858,0.5378437,0.031654153,-0.14414169,-0.009886644,0.43113303,0.23538586,-0.4887151,-0.7618166,0.26218995,-0.06315343,0.11879797,-0.31270775,-0.18294397,0.41790062,-0.9932903,0.12067836,0.40234497,-0.7649515,-0.6770159,-0.305793,-0.58570206,0.52609295,-0.99958163,0.77177143,-0.7181551,-0.86656386,-0.40870336,0.008296859,0.3201601,-0.5637126,-0.12540199,-0.42285615,-0.56274146,-0.19309045,0.60226774,0.013295885,-0.5271239,0.9993501,-0.07843391,-0.46445677,-0.53694993,-0.30316412,-0.5100988,-0.19430746,0.0983116,-0.15128776,0.65885335,-0.56541497,-0.94449395,0.27811384,0.5559033,0.990775,0.47337967,0.5375743,-0.6183264,-0.44166955,-0.40143204,0.07566936,-0.24327011,-0.12124962,0.09599397,0.99945766,-0.43379384,-0.12943338,0.06404433,0.23926139,-0.26661536,-0.4515453,-0.39081123,0.02576441,-0.35015276,0.05032308,0.9833811,-0.19769076,-0.6004835,0.13715602,-0.14477158,0.003426432,-0.95403373,-0.2983226,-0.39113754,-0.3723219,-0.47653553,-0.9980141,-0.46153826,0.55840474,-0.7669385,0.07356692,0.028917665,-0.3223741,-0.22982109,0.6471293,0.14717047,0.82067585,-0.77694553,-0.21119662,-0.27650407,-0.3252792,0.03817862,0.29313263,0.9884459,-0.58017784,-0.9631205,-0.9792667,-0.7351149,0.37263656,0.19997524,-0.2275995,0.46394017,-0.38913643,0.6128315,-0.2273065,0.004626617,0.16627847,-0.24301735,0.25104818,0.3003757,0.36703074,-0.85195774,-0.4794214,0.21868919,-0.67444205,-0.09334573,0.67728484,-0.99859625,0.033074144,0.6338419,-0.004404293,-0.1734101,0.26490137,0.1654678,-0.3932002,-0.38467008,0.16350828,-0.09141028,-0.05099038,-0.49773517,-0.31516722,0.13796973,-0.4059167,0.0765096,0.033488624,0.61491615,0.09861658,0.28260982,-0.4060821,0.060241785,-0.4168524,-0.41250023,-0.016830238,-0.61647004,-0.19199724,-0.99808586,-0.40232754,-0.25875863,-0.5255633,0.57798815,0.6339566,0.894639,-0.49930373,0.46333495,-0.5090462,0.5369145,-0.58312786,-0.46815705,0.49510056,0.3551908,-0.98439723,0.23748662,0.20405525,0.19217058,0.62781143,0.49086154,-0.12949444,0.06928235,0.11339999,-0.23168124,-0.108289964,0.42708492,0.03267569,-0.122770295,0.51078874,-0.1774289,0.6595774,-0.017396715,-0.09704937,0.10428313,0.3078203,-0.110998236,0.6111493,-0.2824295,0.2783005,0.054726034,0.3830018,-0.9980736,-0.08151114,0.58410645,-0.4153523,0.13266231,-0.20428418,-0.28048185,-0.17132057,-0.6822542,-0.45904595,-0.12952664,0.30542496,0.48391765,0.19154343,0.2456939,-0.072877176,0.6140669,0.6172967,-0.41423962,0.709908,0.9749548,0.30021667,0.6792615,0.7212912,-0.5755481,-0.3032225,-0.37486246,-0.025867786,0.5378023,0.043344688,0.99907804,-0.8270627,0.09168557,-0.7662612,-0.3393254,0.20275448,0.5306974,0.9058759,-0.7345252,0.08123146,0.9985744,0.84518033,0.62722427,0.061474167,0.08486253,0.99899095,-0.47871533,0.1803117,0.24855512,-0.67576545,0.79651403,-0.57206476,0.7126182,-0.36610496,-0.20531209,0.8694738,0.48449892,0.08355059,0.61922705,0.27468356,0.30566958,-0.19601874,-0.3749657,-0.8767358,0.65422803,0.5826982,0.7173421,-0.9999779,0.6441192,-0.12075247,-0.63560504,0.271753,-0.85312295,0.6797432,-0.47574392,-0.23069568,-0.31226465,-0.3934487,0.1566244,0.29945952,-0.1620423,-0.426072,0.30929637,-0.5979277,-0.76622975,0.12566857,-0.16089843,-0.41385922,0.3498573,0.0602583,0.12480129,-0.81244373,0.6139479,0.6321415,0.23739283,0.38142714,0.4671139,-0.13430753,0.4253673,-0.9766542,0.064374946,-0.05183766,0.20302576,-0.4456127,-0.25626534,0.21359123,0.9998728,0.07468314,0.71704036,0.60738075,0.3270546,0.65782666,-0.46773845,-0.23296705,-0.6465428,-0.4017493,-0.17816013,0.28265426,0.6632769,0.30515948,0.6964466,0.2906658,0.4733678,0.21932548,1,-0.525184,0.17326044,-0.516469,-0.22333239,-0.63306755,-0.35965815,0.037347674,-0.2854837,0.19945757,-0.34126902,0.164499,-0.64458364,-0.68919456,0.5364483,-0.33788416,-0.1278961,-0.07250079,0.29720882,-0.12675862,-0.90848917,0.6437383,0.48165303,0.4062697,-0.008604415,0.861683,0.046390403,0.685469,-0.10199205,0.45370394,0.011665615,0.10355548,0.992666,-0.09596417,-0.40308622,-0.5957495,0.5690853,0.2564489,0.18597807,0.3074409,-0.41502976,0.9999999,-0.7180055,-0.97210467,-0.08516404,0.9994949,0.15035038,-0.16433415,-0.9999199,-0.17644851,-0.4560634,0.3737612,-0.2383292,-0.6875805,-0.6231119,-0.848578,0.88666517,-0.43467587,-0.5769696,-0.40801683,-0.5977224,-0.4340025,0.078953184,-0.9999688,-0.9989233,-0.9830498,-0.03167018,0.03625622,-0.04393647,-0.38821065,0.06699394,-0.5194633,0.14497247,0.602027,0.36400083,-0.77972883,0.34780088,-0.000293953,-0.1941407,0.54490143,0.03629687,0.011830831,-0.89316803,-0.9999374,0.32412383,0.41017252,0.29346618,-0.33922952,-0.5648161,0.26061487,0.69320816,0.17779657,0.10658266,0.14750808,-0.8336015,0.34017342,0.91138095,-0.07990829,0.44336063,-0.46743992,-0.4797373,0.47347108,0.65826404,-0.6694499,-0.26594558,-0.6267663,0.7950887,-0.9863342,-0.6008039,-0.11847068,-0.1930842,-0.43210885,-0.40234047,-0.2562308,0.57958454,-0.15544443,0.7040569,0.7874845,0.45904568,0.13321956,0.068394616,-0.40146315,0.020401971,-0.7127061,0.99980474,0.8085201,0.69017285,-0.6420905,0.6002925,-0.7469075,-0.13716102,-0.87955487,0.079540715,-0.27639347,-0.527515,0.026342083,0.01655104],
    [39,0,"CCCSP(=O)(OCC)Oc1ccc(Br)cc1Cl",0.8832719,-0.039757214,-0.57842493,0.019683618,0.7255309,-0.39467686,-0.9729135,0.4637264,-0.3737767,0.13325983,-0.82032937,0.3552837,-0.45045412,-0.5169955,-0.11175773,-0.66357845,-0.3355225,-0.23458329,0.020108493,-0.4095749,0.567778,0.28315482,-0.12122033,-0.13854524,-0.5205649,0.6601033,-0.30923107,0.4018923,0.34933275,-0.31959328,0.029377876,-0.23596139,-0.6246082,-0.6784342,0.48333862,-0.69758946,-0.18596146,-0.055624433,0.99056435,-0.86137146,-0.9434647,0.35908666,-0.31129566,0.8066635,0.007089363,-0.8864046,-0.15813673,0.2703412,0.9850602,0.123985074,0.39189282,0.26167527,-0.22148006,0.7850384,-0.7572807,0.27346084,0.07370483,0.38619944,0.43938193,0.64178365,-0.48916832,0.67879343,0.3711964,0.41207978,-0.5615027,0.6675941,-0.29751915,0.45203564,0.1304658,-0.3098861,-0.1364074,-0.15156132,0.16067646,0.16734967,0.33336338,-0.8376592,-0.036470685,-0.31538182,0.12121527,-0.9986768,0.12373232,-0.054389343,-0.9110845,0.031076277,0.1565085,-0.9048681,0.019202799,0.6682346,0.03434965,-0.62480044,0.0678396,0.20829597,0.44578147,0.08669832,0.99308187,-0.032660536,0.69385904,-0.3703815,0.39537448,0.39464653,0.18709068,-0.4853938,0.4466649,0.38810724,-0.79655063,-0.88632005,0.12903391,-0.19039124,0.9839764,0.4886518,0.075892076,-0.4394394,-0.7050745,0.34226894,0.37236068,0.099832706,-0.41987774,0.7545245,0.99761397,-0.16606721,-0.68308395,0.17827801,0.46535054,-0.28128406,-0.35905138,0.28536487,0.4503797,-0.50005025,-0.30983222,0.9999173,0.29385763,-0.36872768,0.35364655,-0.16377082,0.4065696,-0.98411745,-0.47581226,0.2657012,-0.49881992,-0.001526446,-0.994133,-0.37619996,0.9517693,-0.5916741,-0.51932794,0.3311074,-0.66895723,0.5052851,0.31983826,0.7148582,0.31844422,-0.8443625,0.32557392,0.38395166,0.2179395,0.017888432,-0.41734254,0.96376234,-0.84663063,-0.97117347,-0.9098211,-0.83724356,-0.38900858,0.27095363,-0.1009504,0.40216443,-0.20368394,-0.020662226,0.3567808,0.07641837,-0.04252473,0.05867785,0.47797814,0.12205446,0.2952207,-0.7747562,-0.6484011,0.66576785,-0.6570985,0.1573085,0.8728047,-0.8976739,0.2928698,0.21972083,-0.33620676,-0.10754507,0.62486017,-0.31206703,-0.31100774,-0.540983,-0.27616224,-0.53308904,-0.26256263,0.28698865,-0.22122005,-0.04413232,0.7165778,-0.8298629,0.22938748,0.65115404,-0.15618841,-0.29829428,0.12913786,0.3889351,-0.0968221,-0.29307133,0.15584822,-0.67260104,0.5362931,-0.99956936,-0.24902216,0.43798092,-0.4779489,0.052838802,0.21399924,0.15937844,-0.40806514,-0.3170568,-0.59668803,-0.1907004,0.4102445,-0.35295057,-0.41835862,0.31027874,-0.9816596,0.011008715,0.44116554,0.2816518,0.07588908,0.15647464,-0.3213633,0.09481593,-0.38823658,-0.5301921,0.634315,0.00880159,0.12722011,-0.6790132,0.16072436,-0.032280277,0.8783135,-0.23600158,0.13863505,-0.0996015,0.45423225,-0.20658356,0.7901586,-0.50382864,-0.29679054,0.47094008,0.38474974,-0.9976856,-0.80433,0.45998576,-0.52005833,-0.46235448,0.08936068,0.24276076,-0.78971505,-0.18214133,-0.35123357,0.19484499,0.2269856,-0.105695955,0.48229924,-0.0329477,-0.20143363,0.10021262,0.8531769,0.2964384,0.4777484,0.99634343,-0.118447244,0.36253142,0.5869491,-0.7219253,0.040469237,0.092077896,0.24412824,0.64321613,0.26471215,0.9971086,-0.53091943,0.24534702,-0.8473738,-0.39691654,0.71817446,0.9380158,0.77196574,-0.80146897,-0.21833439,0.99441344,-0.19780578,0.83846027,0.5075501,-0.064765826,0.99849707,-0.9926507,0.001082174,0.7060341,-0.15950042,0.5299569,-0.42949623,0.058853157,-0.25073594,-0.4030401,0.54549474,0.7476825,0.11225008,-0.047737315,0.4658862,0.21222249,-0.38483006,-0.36320058,0.21449633,0.543044,0.35782835,0.05238064,-0.99994385,-0.3924711,-0.08049668,0.0575039,0.08976064,-0.9215002,0.7159742,-0.29408592,0.142675,-0.9113975,0.16912039,0.5206772,-0.10126275,-0.15806207,0.26832372,-0.063980415,-0.060726307,0.85767174,0.60464287,0.21133171,0.4464044,0.15026495,-0.2845307,0.19662373,-0.5133223,0.8085228,0.30468926,-0.1052571,-0.06686161,0.5175912,-0.11673965,0.0110877,-0.9793045,-0.45117742,0.59127647,0.04104576,-0.111217074,0.51157695,0.1706917,0.99987817,-0.38443917,0.26477462,-0.28112632,-0.4946055,0.46087453,-0.2004299,-0.8855158,-0.11394977,0.038360253,-0.026061496,0.14934848,0.29112804,0.04717758,0.49899626,0.4420771,0.43165258,-0.15356512,1,-0.10691342,0.10986975,0.12530763,0.6613384,-0.42878485,0.47008252,-0.32214633,0.34542802,0.49124584,0.3658634,-0.27742666,0.57563645,-0.4947766,0.5893188,-0.007571032,0.27124682,-0.46513817,-0.6533842,0.5455819,-0.83519393,0.13523631,-0.7343667,0.38193867,-0.73795563,-0.22843142,-0.099824674,0.2974072,0.57676166,0.0324246,-0.1969579,-0.40329006,0.32135773,0.7350874,-0.26549277,-0.65504223,0.5089476,0.3374808,0.30092523,0.013243224,0.06534463,0.99999976,-0.4797743,-0.96966076,-0.17746347,0.99933165,-0.48507795,-0.6039967,-0.99995524,-0.21557596,-0.56547654,0.50697947,-0.0575227,0.5172579,-0.21977744,-0.35628602,-0.48775327,0.09824581,0.87552065,-0.6840653,0.20347889,-0.14999336,-0.18745698,-0.99994177,-0.99598867,-0.9581723,0.48842585,0.57222444,-0.46001053,-0.47959417,0.08770935,-0.3309327,0.17586195,0.0255243,0.6597211,-0.81360626,0.1727647,-0.5351226,-0.38104188,0.7343035,0.53530085,0.53204364,-0.5488443,-0.9996225,0.22332773,0.18639015,0.22226535,-0.076038316,-0.2662857,-0.9490216,0.48274463,0.46999192,0.521189,-0.1325163,-0.90093285,0.3256251,0.96682644,0.4263584,-0.25819328,-0.001398253,0.34398717,0.045939613,-0.30592036,-0.53400683,-0.7238899,-0.5167295,-0.4315975,-0.96310097,0.087847956,-0.46978116,-0.4103499,0.0762652,-0.6285818,0.010520458,0.5762989,-0.54236966,0.49878538,0.35255352,0.8390032,0.29103225,-0.11899473,0.33979848,-0.42399177,-0.34553525,0.9998196,0.5798956,0.23829319,0.03210629,0.6339473,-0.009105137,-0.3123573,-0.948394,-0.13711737,0.6110582,0.5867264,-0.29542455,-0.27955002],
    [40,1,"CCc1cccc(C)c1N(C(=O)CCl)C(C)COC",-0.7557719,-0.72742456,-0.056733582,-0.84513277,-0.1904965,0.38298643,0.23181665,-0.5026815,0.08223822,0.47921082,-0.5108833,-0.5217588,0.66056025,-0.24848965,0.7785484,-0.76588964,-0.6075194,-0.21810769,0.71882486,-0.3560408,-0.1532548,-0.0584071,-0.03024775,0.52864134,0.52891815,0.05299547,0.55629265,0.3732711,-0.035497975,-0.48000568,-0.46809432,-0.6119343,-0.57883704,-0.38487667,-0.295185,-0.002159759,0.5442598,0.4489505,0.986425,-0.7078005,-0.8571877,-0.46537158,0.114498146,0.19208665,-0.29457265,-0.9608988,-0.26019397,0.64192265,0.98666155,0.29406717,-0.7229387,-0.7174818,-0.11608043,0.3055162,-0.87435895,-0.3471046,-0.054949373,0.27709624,-0.24887913,-0.11840029,-0.108808,0.8105744,0.124860115,-0.45763066,0.11913223,0.57975286,-0.24596167,0.067021474,0.20298453,0.7503793,-0.94280976,-0.9659434,-0.34835044,0.3489332,0.7945365,-0.6476641,-0.16717127,0.3202672,0.3624616,-0.99986094,0.40094948,0.3302066,-0.8939468,0.42603323,0.46137396,-0.6090496,0.23516472,-0.4564533,-0.5041498,0.34955114,0.82273525,0.039388448,0.4538508,-0.22786541,0.98499626,-0.43842927,0.5789135,0.053686336,0.7161805,-0.34714937,0.07690811,0.6553027,-0.66223645,-0.46771392,-0.849525,-0.18608233,0.4773539,-0.026174696,0.98124665,-0.77651966,-0.5532433,-0.075564615,-0.5458186,0.08955156,-0.3231558,-0.028666146,0.47080883,0.42495865,0.99854285,-0.51738966,-0.1570886,-0.16736801,0.33756873,-0.46880832,0.438451,-0.3785492,-0.34133795,0.33500153,0.04897784,0.9996637,0.6113424,-0.09125099,0.16131677,-0.46064892,0.33391887,-0.9958672,0.517011,-0.5148166,-0.8037898,-0.92787606,-0.9958432,-0.15689395,0.97744673,-0.11953207,-0.5989588,0.20758536,0.17534786,0.36123124,0.35552326,0.1834248,-0.21555756,-0.052645005,-0.10082011,-0.004597587,-0.28090256,0.54733354,-0.41909403,0.9247444,-0.94661415,-0.95061594,-0.93970793,0.4452809,-0.08285628,0.4592944,0.6658091,0.2917214,0.49179542,-0.4786149,-0.21069223,0.09049625,-0.013648861,-0.27378777,-0.52831566,0.19576576,-0.3555869,-0.88319606,-0.41986454,0.074910656,-0.003762824,-0.07372231,-0.63226986,-0.4406476,-0.38385317,-0.38311413,-0.012289762,-0.64047813,-0.6921019,-0.39534375,0.5329299,-0.24507739,-0.53753006,-0.25775054,-0.044758055,-0.27457386,-0.7270244,-0.12736617,-0.22338325,-0.9145015,0.13457572,0.027495775,0.49825224,0.53227895,0.63365513,-0.6430219,-0.07615345,0.14736761,0.3175987,0.24067967,-0.3379578,-0.9996692,-0.52311975,0.19628434,0.7485376,0.010277378,-0.16087212,-0.007655377,0.6128306,0.025493465,-0.025147486,-0.43427974,0.5389471,0.28918132,-0.8248812,-0.685623,-0.99625725,0.24371342,0.052191034,-0.08002342,0.09909904,0.42917433,-0.3162782,0.5889725,0.043843824,-0.47395065,0.3419129,-0.8609496,-0.07691594,-0.57124853,-0.7958549,-0.10197583,0.8239779,-0.38950384,-0.11152891,-0.43989867,-0.39423898,0.048714988,-0.2931131,0.124272004,0.32341373,-0.40715188,0.5798621,-0.99871236,-0.45739424,0.21325375,0.47304627,-0.17919146,0.6701801,-0.5559549,0.09765014,-0.010704476,-0.51182634,0.78680295,-0.1348807,0.6569044,0.1549522,-0.27923214,-0.7483266,-0.1443582,0.9840423,0.35843277,0.47781086,0.99639297,0.23695695,0.5334192,-0.20136818,-0.906249,0.12603804,-0.25355285,-0.8858556,-0.13289587,-0.19676115,0.99875426,0.38456106,-0.67001617,0.006353759,0.25156185,-0.1905152,0.87704587,0.91578937,-0.04514214,-0.12726526,0.9916423,-0.26545104,0.9697866,-0.021301119,-0.90398425,0.99714947,-0.98342866,0.19613226,-0.09908353,-0.062904894,0.36443657,-0.017285077,-0.3936358,-0.54900813,-0.5259679,0.013756189,0.26702067,0.0868749,0.5159732,-0.068849675,-0.7289661,0.47190198,0.20140938,0.517588,-0.3091276,-0.31481346,-0.11455126,-0.9999758,0.36437353,0.20258574,0.6651737,-0.5260744,0.032245275,0.4721393,-0.4160519,0.37781802,-0.8475577,-0.21763822,0.23575667,-0.46736547,-0.18493468,-0.49425727,0.12774564,-0.43987674,0.13478959,-0.2755506,-0.13138011,-0.3041642,0.20356613,-0.47438636,-0.19721566,0.650866,-0.06590964,-0.2832082,-0.74082625,-0.016746799,0.16951317,-0.044662934,0.06434968,-0.97221816,0.018138174,-0.7498733,-0.21088211,0.5760578,-0.032263875,-0.32654563,0.99994826,-0.3692242,-0.5055904,0.21595652,-0.766936,-0.6508765,0.39743882,-0.8073483,0.57044023,0.603434,0.3064404,-0.000874157,-0.5466353,0.27712,-0.54768795,0.21055065,0.35997707,0.23774275,1,-0.5736343,-0.18708284,-0.20048814,-0.10110975,-0.24156491,0.8923036,-0.7037884,0.16557457,-0.21840788,-0.5816554,-0.16555804,-0.29771286,0.38426813,0.002334571,-0.1661557,0.58451706,0.5556652,0.35576946,-0.12747617,-0.9275185,-0.21234056,-0.8460848,0.8622292,-0.49299085,-0.6110169,0.88507634,0.034441646,-0.057170764,0.6760661,-0.63512796,0.5806404,-0.63276905,-0.57206625,-0.4613547,0.18403436,-0.21487379,0.39213237,0.31195128,-0.3225352,0.17969982,0.9999999,0.18945242,-0.9777136,0.54514676,0.9997868,-0.05902008,-0.19155474,-0.9999247,-0.6699629,0.43226057,0.26226655,0.13388684,0.315854,0.6713642,0.62532437,-0.1690307,-0.34586245,-0.67125773,0.2968774,0.10450667,0.8612572,0.14245547,-0.9999677,-0.99752825,-0.95217294,0.3082479,-0.78949636,-0.5694354,-0.06357665,-0.61984724,-0.85855734,-0.29096836,-0.42892653,0.010814612,-0.46334752,-0.38789228,-0.3000394,-0.55644065,0.39267528,-0.29765043,-0.26148134,-0.4846058,-0.9998894,-0.57477033,0.44341102,-0.22992711,0.09020714,0.028291272,-0.9621935,-0.09902885,0.044510927,0.17268448,-0.2858963,0.38744625,-0.70137596,0.8832885,-0.13745856,0.35675785,-0.109183565,0.5247768,0.031030333,0.1516195,-0.119554795,-0.22621875,0.5032873,-0.41351023,0.7496619,-0.1796543,0.000818738,-0.28605345,0.18271244,-0.3762991,0.22624674,0.63642377,0.47749713,-0.608636,-0.44565198,0.9256757,-0.7904698,-0.26700908,-0.26696315,-0.29510662,0.49952227,0.9998868,0.22192311,0.19259375,0.6246185,-0.33999297,-0.23000607,-0.13786814,-0.99017954,-0.6392884,0.33321613,0.45365715,0.43817872,0.7056632],
    [41,1,"Oc1c2c(c(O)n1SC(Cl)(Cl)Cl)CC=CC2",0.3716587,0.2543341,0.104096055,0.14102875,0.1573921,0.47780436,-0.77415866,0.08609447,-0.040191893,-0.4888676,-0.19985095,0.060077738,0.00970764,0.63495684,0.33289447,-0.52645415,-0.63470244,0.184052,0.5490171,0.033896632,0.5857606,0.10416847,0.31482658,-0.07776005,0.5216403,0.19176024,0.36100256,-0.23930041,0.27883562,-0.690346,-0.45843568,0.47877857,-0.16413248,0.7109188,-0.15721288,0.42104986,0.79440856,0.20309617,0.9820494,-0.8135308,-0.68836373,-0.19620545,-0.4241577,0.009142539,0.005893328,-0.94266516,0.7477643,0.53655976,0.91772044,0.3021865,0.7922415,0.6956212,0.19796321,-0.056665406,-0.8430965,0.5103605,-0.6686356,0.53476834,0.26288253,0.35657844,-0.36411482,-0.20263702,-0.041236505,0.48380554,-0.061400168,0.73082095,0.2573827,-0.18578322,-0.118600294,0.50812054,-0.8637396,-0.87368894,-0.4968278,0.09538053,0.7557503,-0.6980502,0.8240784,0.6352637,-0.47395524,-0.9987775,-0.85815775,-0.03791418,-0.61212367,0.403615,-0.42387113,-0.7263993,-0.606388,0.10779697,-0.47372383,0.60212743,-0.011662508,0.18847343,0.58523023,-0.001399173,0.9893963,0.044610955,0.11988276,0.6437001,0.24301551,-0.3272816,0.65813947,-0.7325958,0.42323014,-0.0714716,-0.8026313,-0.25350526,-0.25765774,0.67887276,-0.9988096,-0.058937036,-0.3053768,-0.2316343,-0.7581673,-0.17936581,-0.5155876,0.80573475,0.37049016,0.56103265,0.9985985,-0.32277086,-0.44726953,-0.07602529,0.5329607,-0.06988741,-0.4571554,0.6883952,0.41433632,-0.56676465,-0.6960878,0.9988519,-0.43930516,-0.50589323,0.48094058,0.3329571,-0.0868292,-0.34736317,0.34209055,0.40559548,-0.18142469,-0.29014435,-0.9999732,0.47589558,0.97169477,0.777531,-0.24421094,-0.7509307,-0.47263363,-0.34163746,0.3099359,-0.6352863,0.6555895,-0.12590887,0.806241,-0.3191678,0.058576353,-0.33842245,-0.14245014,0.96241134,-0.8129777,0.22246101,-0.94441587,-0.5337855,-0.34367704,0.4497491,0.5778911,0.24558365,0.019946342,-0.6257552,0.64371884,0.24172798,-0.7297212,0.5961881,0.027839625,0.24229917,-0.1014093,-0.25756365,0.42213866,-0.6495343,-0.06685018,0.74461454,0.073973686,-0.16468501,0.27498475,0.70933515,-0.035564438,-0.11893847,0.8029541,-0.0782983,-0.09311337,-0.22839107,0.68165827,0.76526153,0.72296554,-0.343192,-0.87239736,-0.570039,0.6518851,0.33146682,0.29838273,0.37092808,-0.15371157,0.52965915,-0.3846715,-0.24110746,-0.6546818,-0.3942088,0.43246296,-0.02718836,0.043555908,-0.9995777,-0.6357492,0.3524546,-0.43811205,0.76907754,-0.7029596,-0.4147008,0.7608944,-0.42244086,-0.66997164,0.35294545,-0.22293676,-0.5146976,0.38328692,-0.31510702,0.99986416,-0.6589538,0.8472836,0.628659,-0.60141915,0.74867815,-0.4776167,0.062141165,0.16147181,-0.63840437,0.34238422,-0.1719053,-0.7988379,0.03669711,-0.55710214,0.49383155,0.87570655,0.27349928,-0.1774005,-0.10969153,-0.49764663,-0.2415909,0.7075438,-0.40746737,-0.59706265,-0.6822507,-0.5969697,-0.9748553,-0.82577664,0.20831445,0.023515543,-0.7520255,0.1304704,0.8882967,-0.10285764,0.7229117,0.25416052,0.7328873,0.95052904,0.36457616,-0.05392959,-0.69479495,-0.6358716,0.71375406,-0.40658846,0.0910908,0.70868695,0.99902964,0.48910454,-0.71437246,-0.75321734,0.94245356,0.7030342,0.3683867,-0.26883656,-0.6797272,0.757444,0.9985772,-0.5362312,0.6328107,0.1877602,-0.6808195,-0.46218142,-0.11064583,-0.69103265,0.3111225,-0.30019906,0.9959226,0.6080876,0.54150486,-0.40205762,0.013275393,0.99994296,-0.972898,-0.3409783,0.86562276,0.38519084,-0.44809312,0.38911176,0.6498963,0.46390134,-0.68858695,0.70609176,0.8318522,-0.2084272,-0.2819694,0.091124065,-0.59271026,-0.039149024,0.10012089,0.8103076,-0.61517465,0.64991295,0.2528586,0.9170336,0.5086508,0.44441336,0.26698664,-0.06959606,-0.60081637,-0.041523337,-0.57119393,0.10148544,-0.787309,0.34333184,0.5398271,0.3030617,-0.47223225,0.5380547,0.26719075,-0.026830127,0.54715914,0.65850145,-0.32380795,-0.4808774,-0.6066102,-0.2877684,-0.24016665,-0.050000947,-0.32490647,0.17336296,0.01157051,-0.14228618,0.08131971,-0.7240129,0.21075192,-0.9781257,-0.3468567,-0.26027983,0.46446213,0.45331848,0.35479677,-0.2123796,0.99977666,-0.16714829,0.8289624,0.4595509,-0.038543414,0.6371018,0.22231694,-0.6632541,0.12198151,0.5234522,0.76845,-0.6013792,-0.03556098,0.5687967,0.76244074,0.6831801,-0.004553599,-0.598582,0.9951135,-0.41245517,-0.058279846,-0.002149373,0.4812338,-0.8268148,0.03199198,-0.44734448,0.2795038,0.06563553,0.20684713,0.47603124,0.6287357,-0.36825332,0.2183296,-0.607927,-0.419395,-0.4479194,-0.36454654,-0.4123215,-0.14973582,-0.015167398,0.3007513,0.55378115,-0.44539005,-0.23975293,-0.4880373,-0.34294674,-0.056701742,0.33050123,0.32577166,-0.19014534,-0.70960826,0.6983029,0.22080798,0.12525222,0.41227898,0.11213962,-0.67637855,-0.11822992,-0.18618374,0.9463172,0.01114786,-0.9646852,0.8493643,0.9988353,-0.76104635,-0.6050841,-0.9925039,-0.49642938,0.3755225,0.11062727,-0.87173754,-0.23297681,0.33658564,-0.15036848,-0.28559524,-0.59867436,-0.09179957,-0.43767488,-0.35132936,0.08511625,-0.24622811,-0.9999899,0.99778414,-0.97808963,0.21807182,0.48275244,0.5276829,0.08073764,-0.6183151,-0.42421198,0.3273782,0.03254828,0.06255961,-0.10725078,-0.29396436,-0.30511275,0.12122976,0.09310137,-0.036546413,-0.61902654,-0.6676104,-0.99987906,-0.6227605,-0.004041694,0.288182,-0.38698995,0.42722613,-0.92159164,-0.06452481,-0.7013118,-0.7022806,0.8135366,-0.74333453,-0.601075,0.9221117,-0.2247555,0.40786102,-0.6475407,0.5830998,0.08975177,-0.5112918,-0.3088862,0.30079237,-0.6729192,-0.39353812,-0.9926739,0.29211694,-0.04801482,0.23921923,0.25301126,0.25974154,0.2426583,-0.26486441,-0.36927402,0.5696366,-0.15784864,0.68432385,-0.47466537,0.010767821,0.13134156,0.23005384,0.42933032,0.9984607,0.5466815,-0.24088363,-0.20506956,-0.5541259,0.4283119,-0.14731966,-0.982252,-0.42362928,0.3013484,0.58618605,-0.19277859,0.64001125],
    [42,1,"OC12N=C(c3ccccc3)SC1Cc1cc(Cl)ccc12",-0.326819,-0.08292911,0.36524698,0.46002284,0.2509681,-0.40388575,0.50800776,-0.10310546,0.52871495,-0.7491839,-0.21651526,0.22836438,-0.5205398,-0.558756,-0.007182661,0.19386841,-0.47538024,-0.29370597,-0.046871107,0.37343612,0.42452794,-0.29317623,-0.262945,-0.049164493,0.022885013,0.41005903,0.49877182,0.26106703,0.386161,0.17270483,0.31390694,-0.047019083,-0.036716506,0.37773788,0.6639085,-0.033586506,-0.5282496,-0.1055822,0.99712795,-0.9484586,-0.6700141,0.64348876,0.01564193,0.4487093,0.41787487,-0.7648379,-0.19528033,-0.55869496,0.86805665,-0.30701566,0.08828802,-0.03427651,0.52200687,-0.18725285,-0.7375011,0.46935767,-0.70090705,0.22243057,-0.04343511,0.46281615,0.24037072,0.63235426,0.31553406,0.086012244,-0.448836,-0.014952825,-0.47197327,0.5111942,0.18875669,-0.68678236,-0.643919,-0.8470884,0.43160138,0.32605755,0.24392615,-0.6048191,0.56463206,-0.68121856,-0.2670039,-0.997765,-0.19121587,-0.026162226,-0.6667152,0.2564713,-0.11248889,-0.85156816,-0.7512528,-0.12651306,-0.10993448,-0.13493076,0.025727972,0.16733707,-0.38709712,-0.15663692,0.9779559,0.23390073,0.51522315,-0.49585986,0.42132828,-0.36161712,0.07647906,-0.33107865,0.100349545,0.8733834,-0.9581352,-0.70836663,0.8359919,0.48085457,-0.88020587,-0.62042946,0.043357957,-0.5052257,-0.16121745,0.01133798,0.39813623,-0.34040907,-0.17745762,0.12529306,0.99575865,-0.22627473,-0.3747382,-0.17597723,0.5713029,0.3842489,0.2080347,-0.42859444,0.5740175,0.023983642,-0.4419266,0.99985796,0.023027668,-0.38024375,0.44695428,0.31311896,0.3080341,-0.78495437,0.2806944,0.37688655,0.1437381,0.2724769,-0.99999523,-0.16882725,0.9479179,-0.49076095,0.10427408,-0.29561964,0.3984319,-0.37108675,-0.45545506,-0.25515822,0.31331062,-0.34438312,0.3415028,0.36795968,-0.49675602,-0.10785433,-0.079888165,0.8571215,-0.1474464,-0.065797836,-0.88450444,-0.20031045,0.021010753,-0.5365164,-0.36085597,-0.06303704,0.003432134,0.110940084,-0.59923166,0.14936039,-0.41606072,-0.4183807,0.53667223,0.43940637,0.17035107,-0.8352782,-0.47467026,0.28067467,-0.10013537,0.17401841,0.44143218,0.43011972,0.3501904,0.38187498,-0.16199295,-0.42656013,0.28400785,-0.7635789,0.34071952,-0.29296863,0.41340855,-0.09331154,-0.09714883,0.07672723,-0.17278893,-0.4185762,-0.46743733,-0.4608035,0.49764544,-0.17470469,-0.16134027,0.5538633,0.3952017,0.3779667,-0.26251268,-0.35186052,0.33074328,-0.729454,0.098879874,-0.9998882,-0.07958161,0.15021518,0.27668214,0.1536123,0.45028976,-0.5631919,-0.6926892,-0.06263823,-0.44828564,0.28955504,0.45481184,-0.24010472,-0.22345762,0.5226074,0.9007462,-0.61324626,0.7111934,0.26687607,0.57387435,0.72744286,-0.35231376,-0.50720996,0.6523479,-0.26574033,-0.28587115,0.56405306,-0.6738378,0.2273906,-0.57916236,-0.4784841,0.80622774,0.03330635,-0.092068955,-0.61798877,0.42374966,0.419257,0.42191458,-0.377943,0.16843204,0.19384933,-0.33764273,0.20140132,-0.6365161,0.30046535,0.4206078,-0.3945071,0.3111157,0.4257658,-0.14969239,-0.62418,-0.46977505,0.19808684,0.40500486,-0.23986423,0.1646007,0.49044052,0.4270228,0.15916672,0.21100177,0.20397535,0.056034297,0.9980518,-0.5697236,-0.50698066,0.20021819,0.92111397,0.22757582,-0.55084825,0.344118,0.0926735,0.4104846,0.9988701,0.07456476,0.51052654,-0.030526739,-0.6362336,-0.47333544,0.49556562,-0.03492299,-0.10334098,0.32382765,0.987477,0.16749369,-0.27148896,0.27092493,0.8463845,0.99999994,-0.9858978,0.13219771,0.120687634,0.23834868,0.1288192,0.2590505,-0.6512027,0.5768834,0.4480342,-0.42337307,0.5352176,0.034773335,-0.514165,-0.4138204,0.019417485,0.7820188,0.37757915,0.8936009,-0.22861905,-0.0974989,0.4345451,-0.9440573,-0.4218877,-0.2960689,0.094542995,0.42772472,-0.68248606,-0.2464815,-0.06454876,-0.6016694,-0.49024484,-0.40732974,0.18204518,0.27432188,0.57508534,0.16156875,-0.18693455,0.4758242,0.55360854,-0.31436756,0.269253,-0.3920058,-0.2121589,-0.32666022,-0.14903122,-0.11861558,0.2622543,0.74064404,0.28079975,0.47383198,0.029449282,-0.45119134,-0.436218,-0.97647136,0.35593635,0.27572384,-0.31818587,0.69910544,-0.2536914,-0.08720356,0.9998608,-0.6643047,-0.120122224,0.37691054,-0.19824834,0.03592664,0.12163124,-0.91834223,0.03925355,0.49838257,0.30017263,0.05642206,-0.27086553,-0.311107,0.52834404,0.64075315,-0.15136744,-0.30017158,-0.99999994,0.56066734,0.4448201,-0.035643846,-0.024185814,-0.7329344,-0.05195679,-0.107765615,-0.32487902,-0.6338194,0.65453076,-0.74418825,0.09318427,0.25829902,-0.8318008,0.19406597,0.32411736,-0.2709683,0.30205122,-0.029261561,0.67884356,0.38290524,-0.14309664,0.72925663,-0.80712897,-0.25597477,0.5409924,-0.29685,0.62030977,-0.026397457,0.03664769,-0.27108377,-0.20949996,0.23323734,-0.2128466,0.26732135,0.09668919,0.073959365,0.1282196,-0.30572513,-0.2254764,0.9997142,-0.050239004,-0.97734237,0.4683834,0.9995033,-0.39445964,-0.393095,-0.99821144,0.58909255,-0.3706001,0.07216131,0.22304527,0.17069092,-0.032418106,-0.38913324,-0.28438717,-0.578712,-0.100384615,-0.43207026,0.5965905,0.06508105,0.42565998,-0.9999927,1,-0.82443637,0.16872844,-0.23065425,0.4910022,0.07212591,-0.24212575,-0.5735658,0.8927577,-0.18468107,0.12737052,-0.4635417,-0.48128536,0.241665,0.3920821,0.20575513,-0.35606238,0.23964833,0.12201645,-0.9999126,-0.1340607,0.45573005,0.36567298,-0.6546113,0.2065458,-0.9699012,-0.59746975,-0.6045077,-0.31441614,-0.22415341,-0.25194332,0.6171519,0.7830521,0.0988393,0.74873984,-0.49408838,0.19272797,-0.07345009,-0.5290616,0.4688993,0.27738214,-0.14106624,-0.52185994,-0.9527531,0.15275949,-0.38735873,0.25877935,-0.001294802,-0.48122367,0.32158875,-0.45358893,-0.20509365,-0.2701394,0.12076639,0.97364324,-0.6668206,-0.525097,-0.20984778,-0.25809336,0.20831943,0.9998177,0.48644024,-0.18226248,0.55914026,0.085927516,-0.34328148,0.5309136,-0.9755918,0.06605416,0.44841996,-0.2587415,-0.06383186,0.4551757],
    [43,1,"NC(=O)NN=Cc1ccc([N+](=O)[O-])o1",-0.5646625,-0.27917954,0.28266367,-0.32097816,0.060890205,-0.67644554,-0.6665488,0.82256013,-0.021658964,0.007029982,0.8400964,0.61923844,-0.18934892,0.08773154,0.2428916,0.33931863,0.72373813,-0.5114472,-0.29907945,0.59125966,0.83701986,-0.6220713,0.058244493,0.87641746,-0.5064593,-0.077341005,0.81782883,-0.07371238,-0.58727974,-0.1669163,0.19710892,0.43376985,0.08386598,-0.059756815,-0.085922986,-0.47990626,0.1297782,0.7793951,0.8223156,-0.2327861,-0.9932341,-0.047919504,-0.15806499,0.043154404,0.35509485,-0.98460144,0.3755886,0.2720771,0.73871887,-0.65903085,-0.05627274,-0.012789718,-0.13568692,0.15359598,0.09801712,0.76484257,-0.5187,0.9002349,-0.2670253,0.32161137,-0.13834204,-0.04223798,-0.54037476,-0.19653478,-0.07137315,-0.12651914,0.54274064,-0.4138024,0.65831757,-0.6430845,-0.90327823,-0.99986535,0.26271185,0.1074711,-0.7811142,0.6304312,0.27932957,-0.17099722,0.17885421,-0.9995189,0.22519036,-0.82949626,-0.8573959,-0.442793,0.47480103,0.9115506,0.1844746,-0.3315018,-0.82565904,0.5502357,-0.6118822,0.2182028,-0.31045768,0.30413795,0.99987286,-0.5914913,-0.9167907,0.23278865,0.14143685,-0.044400387,-0.5744495,-0.0626438,0.41664615,0.6237515,0.30274022,-0.9070453,0.46952465,-0.794017,-0.99991775,0.1357867,0.27574527,-0.41162395,-0.6988084,-0.02371954,0.20130716,-0.5186394,-0.30251506,0.33899745,0.99954444,-0.69119865,0.31035206,0.69246626,-0.34042975,-0.599226,-0.6659852,0.38076824,-0.48554125,-0.43166953,0.22724158,0.7397181,0.45642665,-0.28600892,-0.26684657,0.4957627,-0.031199574,-0.79158556,-0.33738092,-0.5132818,-0.027009223,-0.24494004,-0.9997505,0.29909438,0.1463023,0.4794984,0.8360577,0.086144194,-0.38019225,-0.10577355,0.8912953,-0.30263063,-0.37720156,0.8960456,-0.38175535,-0.15605876,-0.029785296,-0.61669874,-0.08304197,0.9945158,0.33527184,0.65488636,-0.9917969,-0.55605507,0.12010631,0.08284176,-0.44801527,-0.20966786,-0.6172651,0.56492394,-0.39859423,-0.19641367,0.37160274,-0.07574248,0.60373354,-0.27556956,0.7433707,-0.592346,-0.74571824,-0.5124308,0.44587654,-0.24442747,0.28683534,-0.99961495,0.26144323,-0.118470795,-0.5506492,-0.046190675,-0.02720949,0.16080236,-0.25573298,0.2840622,-0.058221478,0.39349654,-0.6056955,-0.4694312,-0.026651265,0.1680509,0.37686726,0.8978301,-0.16471642,0.029530147,-0.28228626,-0.20491642,-0.5937931,-0.012192583,-0.17121495,-0.6495722,-0.12456185,-0.16595128,0.56696516,-0.9913334,0.31976214,-0.59646845,-0.13287084,-0.20502575,-0.64560676,0.8513312,0.8682044,-0.27545717,-0.49767298,-0.27168635,0.5821927,-0.27190524,0.110664204,0.60156447,0.9902094,0.2175546,-0.07997546,0.20904765,0.09747851,-0.3836457,-0.2349183,-0.37671575,-0.3605764,-0.38416377,-0.3520547,0.053267837,-0.07090452,-0.34365386,0.24575306,0.19097461,0.19807869,-0.2634867,-0.0855832,-0.3912675,0.08256776,0.47264817,-0.29523966,0.09807981,-0.098932944,0.09304793,0.6741754,-0.9981233,0.5816911,0.44141448,0.3366686,0.15678853,0.087483145,-0.30101988,-0.28069988,-0.22966734,-0.46728277,-0.45471296,-0.783605,-0.23666638,0.55292165,0.2580279,0.40804908,0.6403916,0.21067607,-0.3400366,0.4397437,0.930646,0.50206023,-0.1136365,-0.34739414,0.889818,-0.26427183,0.56666803,-0.048412193,0.51201904,0.8146312,0.9995221,-0.15115653,0.43250054,-0.08056651,0.026963057,-0.61082405,-0.96714944,-0.99715656,0.42243928,0.32156774,0.99916947,-0.23821777,0.34404916,0.44890347,0.49492654,0.9995502,0.45593834,0.05240214,0.24322698,-0.2882399,0.033204403,-0.5924375,0.26596588,0.2731637,0.14273466,0.9568085,-0.25639766,0.4485356,0.1596422,0.13971175,0.27234674,-0.36153466,-0.31163123,-0.9469142,0.6369703,0.44810948,0.69594043,0.9794779,0.4329157,0.2542934,-0.42829397,0.46991634,-0.46160454,0.3363698,-0.28481242,0.5132386,-0.458163,0.20990872,-0.20260496,0.54866284,0.21794027,-0.80346394,0.28933844,-0.1193859,-0.98896945,-0.25589985,-0.13718489,-0.59160906,0.2918595,0.6809971,0.49918112,-0.57222486,0.7828748,-0.4942655,-0.059970368,0.51277214,0.20425852,0.20439279,0.67782426,-0.98917574,0.110348284,0.04176602,-0.15679963,-0.4144215,0.48083648,0.2129769,0.99918747,0.39952812,0.56988955,0.54276145,0.37655732,0.72949016,0.5840785,0.55204946,0.19154586,-0.19870535,-0.27704433,-0.52544457,0.15483063,0.17512353,0.3447016,-0.15520792,0.49493912,-0.22533798,1,-0.46489978,0.20851575,0.31831944,-0.12724899,-0.7474022,0.095825054,0.5593558,-0.0669245,0.8519989,0.2607712,0.06449047,0.28936818,-0.17276093,0.7139297,-0.74563885,-0.79899347,-0.06429722,0.2596331,-0.047896285,-0.68579525,0.59122247,0.778926,0.0500469,0.44507164,0.9547623,-0.02713948,0.31923476,-0.4575651,-0.5833483,-0.023594102,-0.42012087,0.99597883,0.68112963,-0.5776992,0.63910973,-0.004919314,0.32591817,0.7174734,-0.15932131,-0.55590266,0.92772627,0.039801896,-0.8617317,-0.21951558,0.99963623,-0.3537878,0.030121699,-0.95503664,-0.69124866,-0.057321504,-0.074384496,0.34902805,-0.8918883,-0.7027253,-0.7355661,0.94620925,0.686724,-0.5701004,-0.675618,0.48731595,-0.24703622,0.121409036,-0.9999644,-0.9982765,-0.98572654,-0.101001784,0.28399622,0.43594232,-0.5678073,0.48339525,-0.6620936,-0.64123476,-0.022019908,-0.5392932,-0.24614173,-0.3711294,-0.123209044,0.33439004,-0.15245235,0.046962973,-0.081088066,-0.9710007,-0.9999571,0.21044114,-0.2982971,0.42078373,-0.7413269,0.4318189,0.854275,-0.053577315,-0.16591564,-0.3763828,-0.08904144,0.22106344,0.43131408,0.9492697,0.39326283,0.8735244,0.017725492,-0.7481994,0.4805602,-0.08996665,-0.18443708,0.3483167,-0.40912077,0.95461094,-0.2731126,0.40739998,-0.16533959,-0.045269243,-0.5227773,-0.47237,0.15572315,0.33795854,-0.4425001,-0.26808283,0.4270242,-0.032994997,0.6053205,0.3010586,-0.45142868,0.45050403,-0.75818944,0.9999604,-0.42367074,0.49476677,0.253739,0.14593832,-0.053349506,-0.46919832,-0.8353268,0.5145688,-0.4882101,-0.780924,-0.23815271,-0.34539253],
    [44,1,"O=C(O)CCCOc1ccc(Cl)cc1Cl",-0.5867615,-0.23454894,-0.58395106,0.40216213,-0.0298434,-0.5047647,-0.20079792,-0.39881256,0.21102637,-0.18904297,-0.3753273,0.12010264,0.10746416,-0.56925774,0.0733515,-0.30536482,0.77099067,0.24119453,0.744912,0.098265,0.35431078,-0.77523345,-0.1787752,0.033565894,-0.23044515,-0.09885389,0.39943138,-0.033488028,0.16586068,-0.17518896,0.20335637,0.62910193,0.18646489,-0.43737552,0.41856384,-0.63453513,0.011587454,0.28006116,0.7306993,-0.8876778,-0.9951083,0.34897184,-0.34173515,0.5633559,0.24210595,-0.98761564,0.05650648,-0.20845492,0.7653651,-0.050864384,0.6368198,0.10948835,0.22375955,0.03520042,-0.7705164,-0.56104094,0.6640206,0.9341667,0.25583786,0.5148291,-0.34631523,0.04227364,0.11349883,0.3780573,-0.38494083,0.35148004,0.30566296,0.16814432,0.08900616,-0.2907033,-0.7819872,-0.93884814,0.013166,0.071252376,0.6074531,0.4133373,-0.24115111,0.22266765,-0.10075741,-0.99938184,-0.3283407,-0.4711037,-0.7429216,-0.57587296,0.6779146,-0.5214198,0.49484748,0.35304445,-0.34996468,-0.28531617,-0.118017256,0.6498968,0.21412064,0.4955771,0.9883469,-0.35694945,0.21377656,-0.02494008,0.001987045,-0.47884855,0.5999099,-0.49170044,0.46893412,0.757168,0.6041967,-0.50118643,0.20111951,0.084299035,-0.87269276,0.27040905,-0.012608569,-0.51164126,0.32600325,-0.4600281,0.029790288,0.36822557,0.67318225,0.6407099,0.99857515,-0.080276236,-0.08080002,0.050551787,-0.2500739,-0.036597595,-0.2709836,0.3356337,0.39423364,0.24056898,0.14296992,0.9997625,0.47764313,-0.3158723,0.57888836,0.130709,-0.33756545,-0.7720789,-0.27293566,-0.069143526,-0.31735694,0.006295155,-0.9985677,-0.1990494,0.9678068,-0.2975005,0.18685123,-0.014160223,-0.18235576,-0.22717889,0.9787113,-0.1397436,-0.13226177,-0.53668964,0.107592985,0.53515655,-0.43555278,0.13341029,0.22417967,0.9964212,-0.3891058,-0.66946477,-0.97911376,0.12225333,0.052841768,0.15269566,0.22067472,0.2815168,-0.43002206,0.097289935,-0.5904445,0.122748755,-0.030560333,-0.2580209,-0.43004698,0.3641527,0.76942915,-0.96935225,-0.6085581,0.24944358,-0.34791458,0.5161682,0.29369557,-0.7665261,0.08847648,-0.18456765,-0.8771396,-0.30351815,-0.2751499,0.37764037,-0.068893865,0.16738999,-0.19552387,-0.23882411,0.041977197,0.1397894,0.099440224,-0.32299566,0.37551963,-0.5192311,0.30458286,0.3151201,-0.44850725,-0.10647523,-0.6068026,0.555131,0.6532811,-0.21619037,0.27337134,-0.5174464,-0.053546183,-0.99102575,0.6776807,0.6775591,-0.005993994,-0.42164403,-0.42878616,0.07393067,-0.19720243,0.266683,0.40181428,-0.23588616,-0.6237526,0.13507825,-0.5393778,-0.23900318,0.9932361,0.09186655,-0.011492864,0.5063807,0.047808632,0.26863936,-0.23317109,0.2055138,0.14505903,0.08751957,0.22826152,-0.25630018,0.23312515,-0.039217863,0.22267282,0.3392358,0.8978783,-0.30095786,-0.11255975,-0.56433016,0.49934173,0.2932859,0.26693565,0.20864514,0.31956992,0.001155862,0.4530359,-0.9982747,-0.3421486,0.55646956,-0.1692494,-0.40162596,0.18894815,0.07409071,-0.23337984,0.024362618,-0.09411429,-0.16782692,-0.32126117,-0.7067611,0.60297835,0.30079237,-0.12980469,-0.21374582,0.5218116,0.08330845,0.47673383,-0.06378035,0.16854443,-0.021647712,-0.2807064,0.89738256,-0.5375291,-0.41434452,-0.2944672,0.39234623,-0.065490715,0.99943405,0.22211796,0.47051853,-0.20597492,-0.32787743,0.110050134,-0.109796524,0.6435928,0.3602797,-0.63317007,0.99897563,-0.20359291,0.167082,-0.14772527,0.6015526,0.99848324,-0.96164733,0.068230435,0.6224695,-0.055568185,-0.39960596,-0.20507582,0.2864042,-0.11561053,-0.43496856,0.95301795,0.52293324,0.44893482,0.03761596,0.393308,-0.33469564,-0.62600297,0.26107523,0.51149464,-0.31376967,-0.05853159,-0.121142656,-0.9731463,-0.12698708,-0.5649633,0.22449629,0.2097023,-0.8637741,-0.26796305,0.3290716,0.38867286,-0.97526723,0.44142488,0.37290043,0.09556356,-0.351608,0.038432747,-0.33603776,0.4063748,0.065753125,-0.44625157,0.69982314,0.26083142,0.5919043,0.067591555,-0.4722142,-0.0938824,0.69928527,0.51477635,-0.04884185,-0.18526751,0.090622805,-0.2671063,0.697374,-0.9963021,0.2930036,-0.36030817,-0.14609249,0.005965073,0.18711193,0.05388896,0.99934554,0.09307712,-0.12593839,-0.11615659,0.39494503,0.47983524,0.082262166,-0.76703644,-0.00410142,0.5459133,-0.5761599,0.1001452,0.3274061,-0.29905242,0.11924036,-0.3368491,0.8178112,0.001639003,1,0.23380558,-0.56838614,0.263685,-0.5385535,-0.5211132,-0.5369651,0.5632176,-0.3725737,0.3776317,-0.4669091,0.08086972,0.17668867,-0.004020646,0.37566447,-0.16081713,0.29485404,-0.5642879,0.23234978,0.67854714,-0.47089726,0.43121186,0.1904098,-0.48228937,-0.17421906,-0.55900574,-0.03175644,0.12632485,0.3362714,-0.096180126,0.15999682,-0.693858,-0.14199705,-0.5821961,0.47160172,0.13819736,0.28473693,0.26742318,0.35234845,0.032110725,-0.13050209,0.9999702,-0.06506716,-0.9942918,-0.05191851,0.99969983,-0.6941349,-0.27598783,-0.9985913,-0.0383232,-0.046300147,-0.5163611,-0.18909162,-0.15239605,-0.33782205,0.33977705,-0.11663655,0.04686937,0.63669765,0.10377271,0.028599748,0.16982275,0.19511484,-0.9999635,-0.9982747,-0.96965677,0.24424669,-0.03277462,-0.3487013,0.0811484,-0.40611744,0.17657156,-0.29783788,-0.2879304,0.5037839,-0.7126277,0.32066447,0.32356447,0.46933886,-0.1342625,-0.07278673,-0.2239337,-0.9308222,-0.99985355,0.0557836,-0.24906452,0.5918642,0.28997084,0.2713692,-0.9737119,0.081354916,-0.29197267,-0.20446098,-0.03932034,-0.4299745,0.65388954,0.9533194,-0.041197736,0.8701343,0.49384585,-0.5879516,0.08461505,-0.7027537,-0.12109031,-0.00723329,-0.31416446,-0.26241398,0.84894544,0.7390452,0.075534336,0.04533235,-0.030028647,-0.46147048,0.49281567,0.15541023,-0.7489366,-0.23024994,-0.061517015,-0.029220155,-0.255027,0.34402126,-0.14718944,-0.07468433,0.6174019,0.9999666,0.68485546,0.09283597,0.42895678,0.350272,-0.4876237,-0.23339947,-0.5016335,0.0732266,0.5754051,0.44385102,0.48559892,0.18732391],
    [45,0,"CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1",0.6129227,0.43761992,-0.37743503,0.17290093,0.391471,-0.6377628,-0.78602225,0.20630044,-0.65312976,-0.341955,0.4771069,0.25045422,-0.5745312,0.24821272,-0.018502995,-0.6573329,0.060104817,-0.5139041,0.15564562,-0.63679624,0.05935234,-0.053991213,-0.39805838,0.2303984,-0.12368991,-0.035707396,0.076626144,0.1739523,-0.15508978,0.6234378,-0.062053893,0.04051534,0.51395804,-0.4109741,0.6980236,0.2789725,-0.0085443,0.49179465,0.99888074,-0.45313135,-0.89875865,-0.13409877,-0.12670274,0.7184591,-0.49322474,0.4315181,0.25121918,0.26686776,0.96162695,-0.38615122,0.9075703,0.31840393,-0.84702146,0.25556958,-0.07080259,-0.16361864,0.2381693,-0.59719527,0.4308482,-0.49075046,-0.07532437,0.082699545,0.2695622,0.016833011,-0.35738027,0.5117525,0.11852779,0.30545002,-0.19935848,-0.14557825,-0.46018332,-0.4479398,-0.5681627,-0.6382467,0.58458847,0.42548278,0.1282808,-0.019289147,-0.33533853,-0.9996455,0.7506052,0.12157749,-0.93762785,-0.389463,-0.020861687,-0.96794987,-0.20636074,0.23097494,-0.07501596,-0.7314131,-0.70801765,0.42155942,-0.108552895,0.7377485,0.9982035,-0.23318629,0.4921882,-0.71955305,-0.36099985,0.30252677,0.06888665,-0.17379616,0.12472326,0.987452,-0.99705553,-0.9209157,0.2756833,0.48433644,0.9748219,0.4214548,0.26582813,-0.46779647,-0.29561412,0.07661103,-0.20139211,0.6558329,0.08558915,0.5022632,0.95194083,0.19248779,0.62124914,0.6229699,0.11062764,0.041488815,-0.5706036,0.24902964,0.096863106,-0.8344479,0.11217617,0.99972105,0.22417647,-0.66131634,0.23283298,0.048168104,-0.64764917,-0.9955377,-0.77785957,0.36760366,-0.15429431,-0.28084132,-0.9999327,0.15182364,0.6865344,-0.27210248,-0.06441784,0.37793833,-0.23087779,-0.56663257,-0.9825304,0.2757746,0.43764508,-0.7927276,0.40016577,-0.1638739,-0.16924587,0.38550648,0.34686163,-0.40537986,-0.5310266,-0.94023675,-0.5252526,-0.6741022,-0.50436926,0.50630015,-0.4211404,-0.38485405,-0.59645647,-0.09365373,0.3210844,0.016559616,0.5832099,0.039850675,-0.14555264,0.38542616,0.43607113,-0.83882344,-0.45801222,-0.33671513,-0.62446064,-0.45311472,0.31482857,-0.8662473,-0.07406275,-0.1286091,0.37384117,-0.4331604,0.6761927,0.44429114,-0.470516,-0.41637433,-0.6380843,-0.26105413,-0.6601117,0.087468274,0.48136187,0.013951736,-0.30084732,-0.9017548,0.27043673,0.13786763,0.5022134,-0.60175467,0.12603381,0.20322348,0.55305535,-0.78994024,0.02953397,-0.78245956,-0.48275486,-0.99989086,-0.3682134,0.19428155,0.06430266,-0.0772442,-0.10656253,0.54982555,-0.074010454,0.29826042,-0.10202602,-0.44337824,0.3637675,-0.24397008,0.19906512,0.17476834,-0.9923851,0.5194781,0.46959248,-0.14372689,-0.4810647,0.5643518,-0.08899434,-0.3814722,-0.044824768,0.3402064,0.4041924,0.23537405,-0.20099401,0.15649895,0.798414,0.044175517,0.92552006,0.56592584,0.11900311,-0.52793205,0.5995299,-0.12954278,0.27216306,0.5695921,0.38743877,0.58821726,0.07255452,-0.9664723,-0.5752498,0.76818436,-0.1368171,0.14105813,-0.42456403,0.29259932,-0.23602965,-0.41564977,0.30387786,-0.6244661,-0.16883884,-0.60329735,0.31115812,0.5597747,0.08511562,0.45383322,0.9593232,0.09548529,-0.21364994,0.99335986,0.5642429,0.022515416,-0.5951102,-0.63064545,0.3226045,-0.44977722,-0.057768393,0.058179427,-0.4600931,0.9935135,-0.29802015,0.21995792,-0.6636827,0.013453546,0.07923696,0.89950967,0.82011396,0.07617412,-0.12587294,0.725187,-0.6005324,0.16149397,-0.5352289,-0.003860752,0.9999462,-0.9864696,-0.2224724,0.44687983,-0.4582501,-0.045273352,-0.650174,0.16092835,-0.18170956,-0.3786139,-0.9913536,-0.0486134,0.9184246,0.3066247,-0.29613894,0.6472581,-0.5177332,-0.28131697,0.3980502,0.42437935,-0.5195226,0.45401156,-0.99991804,-0.62562466,-0.2310135,-0.3149159,0.710781,-0.8455918,0.34198627,0.533463,0.23857605,-0.8049183,-0.36173663,-0.15175314,-0.18248948,-0.7374331,-0.5166831,0.6017051,-0.42285675,0.8138378,0.7651473,0.34184182,0.6907722,-0.11084418,-0.38868836,0.7724408,0.28133252,0.5333053,0.041534238,-0.5412418,-0.09196274,0.751722,-0.009851493,-0.89029336,-0.87282395,0.43118006,0.6387132,-0.33986247,-0.52881354,0.6334766,0.6677051,0.9998683,0.7216523,0.0609598,-0.25315467,0.5226068,0.58184355,-0.2926973,-0.83291125,-0.22850278,-0.48937893,-0.6763712,0.41572815,-0.14739482,-0.16260268,0.09154059,-0.49025133,-0.4079233,0.47228983,0.98853713,0.26551864,-0.011496599,0.4747875,0.065533325,0.48558772,-0.56042045,0.22528154,0.025725488,0.3685318,-0.6513356,0.61902237,0.7272647,0.17004736,0.3626712,0.11169993,-0.051724937,0.1397402,0.19998036,0.59459645,-0.29939586,-0.27807385,-0.41735727,-0.7743135,-0.18517627,0.7812984,0.44198942,-0.2252851,0.19082782,0.3189491,-0.8527012,-0.27525043,-0.34765673,0.13277678,0.53498566,-0.5085186,-0.06714628,-0.029816661,-0.20035665,0.65543985,-0.050738428,0.9999998,-0.585922,-0.9024381,0.11500715,0.9997095,-0.5538193,-0.3894905,-0.99990547,0.2640965,-0.9613747,0.35427013,-0.43197012,0.45839036,0.32700032,0.06009832,-0.5583962,-0.035493355,0.58544147,0.27254945,-0.19342314,-0.2406646,0.014389314,-0.9999561,0.9985474,0.46187907,0.23161764,0.15671496,-0.5394685,-0.33743015,-0.08227162,0.316232,-0.33065626,-0.44745034,0.6165199,-0.8608163,0.18890975,-0.058229685,-0.1766785,0.49961206,0.53882897,0.026552012,0.84551275,-0.99954385,0.35120985,-0.6099404,0.45318303,0.63135254,-0.091171116,-0.8480022,0.71494746,0.5384999,0.48382437,-0.3180973,-0.58946866,0.13918896,0.9808903,0.24058826,0.4629317,0.35663542,0.42305526,-0.53482735,0.1404665,-0.5877934,-0.6493664,-0.043313287,-0.26155534,-0.7803512,-0.42522874,-0.09392507,-0.086647384,0.21806696,-0.28640398,0.68562484,0.67287004,-0.92103297,0.4404347,-0.26723617,0.99818873,-0.18004999,-0.2624971,0.39940974,0.055844393,0.025054818,0.99998724,0.66165274,0.566027,-0.5979453,0.1828754,-0.5646761,0.100211926,-0.9966616,-0.22208497,0.50005096,0.061341245,-0.19680405,-0.24250928],
    [46,0,"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1",0.97371185,0.47970676,-0.35686308,-0.67207247,-0.70921344,0.3391955,-0.9488385,0.5140401,-0.46216834,-0.07197415,0.112530924,-0.5885243,0.5535191,-0.1980233,-0.33650064,-0.74523574,-0.68192273,0.46199977,-0.35916343,-0.5611834,0.16835119,0.31006145,-0.01544497,0.69312656,-0.23048477,0.17183223,-0.40260783,0.2946395,-0.5000344,0.27913576,-0.56087595,-0.80048305,-0.5967832,-0.55757266,-0.13751289,-0.6658408,-0.7365764,-0.10377258,0.9935632,-0.61638266,-0.94669616,-0.39520955,0.84765786,0.29613608,-0.002921757,-0.7339919,-0.20525065,0.63319147,0.98382854,-0.35462886,0.4330111,-0.84122944,0.058404166,0.3163134,-0.50434613,0.70526814,-0.7445257,-0.1953,-0.7824569,0.112215996,0.47859326,0.000464646,-0.18459755,-0.4374031,0.003391541,0.62631863,-0.59285945,0.03552807,0.34294042,-0.049158502,-0.51593596,-0.9850598,0.045761418,-0.29456994,-0.49833485,-0.8284364,-0.47957784,-0.8250754,0.69979703,-0.99944466,0.7343742,0.29548714,-0.9444247,-0.45864114,0.8031006,-0.19734207,-0.53637326,-0.06150612,0.58953446,-0.15776934,0.3745154,0.413774,0.50233334,-0.50255144,0.9995151,-0.014307148,-0.4883105,-0.18573469,-0.4152968,-0.6520628,-0.08971998,-0.03326966,-0.26740494,0.11362529,-0.9530121,-0.99430954,0.32976243,-0.10687252,0.9868833,-0.34182537,0.8286996,-0.6213519,-0.3237188,-0.770093,0.3724844,0.05712644,-0.31357798,-0.48415703,0.9979848,-0.321714,-0.25864172,-0.44108948,0.5011315,0.3281727,-0.5112755,-0.52602077,-0.3671371,0.19559912,-0.21218167,0.9875793,-0.77742094,0.097175315,-0.11272323,-0.46708825,-0.40758684,-0.93992746,-0.5970049,-0.37549078,0.04193378,-0.62596095,-0.99968374,-0.04431644,0.6294607,-0.85451156,-0.6782781,0.06096439,0.5168099,-0.23594114,-0.5609735,-0.043770675,0.67757356,-0.7886386,-0.6393293,-0.11262641,-0.41571826,0.19005553,0.0972111,0.8872652,-0.83149636,-0.972318,-0.8615401,-0.25631788,-0.6079326,0.64901984,0.49995938,-0.6988312,-0.13847423,0.54329723,-0.4963153,-0.76500225,-0.14381842,-0.26515934,-0.1965066,-0.59818107,-0.21066621,-0.18717495,-0.57988554,0.20708828,-0.93878144,0.16035862,0.30254793,-0.98560184,-0.1904852,0.3465345,0.70780635,-0.37753996,-0.04171759,-0.13736755,0.06845772,-0.27271128,0.90351075,0.4638515,0.68313706,-0.31018412,-0.22852157,-0.25848073,-0.83176285,-0.92117095,-0.50632364,0.29505062,0.2971517,0.3765593,0.4362093,-0.2302001,-0.20109694,-0.01264188,0.63020414,-0.82240796,0.3758241,-0.9996814,-0.11768677,-0.28484043,-0.351224,0.8706751,0.5884145,0.6419398,-0.73260576,0.22064045,0.50205153,0.1208903,-0.54532784,-0.6986082,0.51795495,0.2687044,-0.9951301,0.01226665,0.18034351,-0.17522618,-0.2236281,0.030814942,-0.24267915,0.56949735,-0.27835363,0.62548137,0.34524906,-0.29834783,-0.46562082,-0.07721144,-0.2628014,0.53279275,0.8699676,0.40345863,-0.548495,0.58331954,-0.5726354,-0.33500215,0.52956545,0.4284045,0.006927303,0.24141079,0.15201214,-0.99877197,-0.7751815,0.50997984,0.067317426,-0.11319331,-0.503982,-0.023550346,-0.07633512,0.54457164,-0.08033762,-0.3327747,-0.4104219,0.054851174,-0.24064709,0.22672379,-0.45326892,0.14534956,0.43910092,0.33609265,0.7804744,0.999747,-0.69161606,0.92985564,0.64770013,-0.9713932,0.21953046,-0.08948313,0.29324552,0.5962975,0.12295124,0.9963966,-0.5596679,-0.29885006,-0.63589215,0.072725944,0.2847968,0.55263,0.7990693,-0.82138664,0.8353382,0.99239117,0.7015648,0.91061795,0.57501423,-0.027457831,0.9970736,-0.71531767,-0.03661879,0.35343513,0.037720438,0.38837752,-0.50495356,0.21145287,0.6292004,0.81742364,0.124416664,0.5966496,-0.034620676,0.3816286,0.2147408,0.6163191,-0.4430719,-0.44722846,-0.35369557,-0.07159123,0.14080238,0.2693487,-0.99995667,0.69916517,-0.034075342,-0.6140393,-0.42150217,-0.55856085,0.92336786,-0.50516766,-0.3168181,0.2201595,-0.40719062,0.43453604,-0.18138048,-0.65735334,-0.48935184,0.41883102,-0.89539456,-0.47679707,0.78277135,-0.6904864,0.18743244,0.4344051,-0.1595253,-0.3022184,-0.28631333,-0.025250884,0.31634805,-0.48191687,0.7502752,0.65655345,0.6901959,-0.15088065,-0.90752,0.32927847,0.024362803,0.24593577,-0.14119577,0.083631314,-0.12693506,0.9998939,0.7048,0.5475616,0.5718154,-0.44493225,-0.052966766,-0.15507258,0.3727502,-0.8161025,-0.18180402,0.5530027,-0.3900568,0.28085577,0.12075866,0.51805407,0.35778826,-0.6898396,0.69739723,1,0.27563342,0.006751213,-0.6388803,0.023875304,0.029260302,0.357445,-0.27659217,0.7923075,0.123578586,0.13779847,-0.4301326,-0.7123092,-0.35002184,0.5250571,-0.041340817,0.77834374,-0.4352785,0.1808253,0.18481421,-0.94936264,-0.09757565,0.024995042,0.51151115,-0.42592412,0.8574134,0.18160982,0.20294082,0.55730534,0.39140356,0.10382244,-0.17749059,0.57999754,-0.4403009,-0.43170527,-0.8421452,0.015003612,0.25752646,0.46575096,0.5674932,-0.25641963,0.99999976,-0.13880928,-0.97301024,0.17511374,0.9985975,0.38731277,-0.1489416,-0.9999128,0.22290576,-0.8821363,0.25304583,0.47336698,0.14660311,0.7706246,0.15742244,0.82407314,-0.6688735,-0.52756315,0.005367631,-0.21311936,0.60859776,0.8301998,-0.9999018,-0.99727786,-0.94977796,0.180904,0.61536115,-0.3658965,0.5615353,-0.1027769,-0.64943945,0.3642177,0.8786897,0.3632154,0.02192593,0.4263188,0.49214,0.1893312,0.63516873,-0.22543812,-0.5442516,-0.5004634,-0.9997707,0.5485086,0.21665247,0.22403294,-0.18431598,-0.23022704,-0.032301754,0.8400135,0.47817656,-0.81047046,0.6827972,-0.80633247,-0.47742558,0.9518272,-0.71656775,-0.060493268,-0.41856933,-0.6725863,0.11312336,0.56479025,0.5616006,-0.085179254,-0.35852674,0.8962188,-0.9880249,-0.34094593,0.47436547,-0.25463942,-0.084169716,0.3689667,-0.081889465,0.6539994,-0.3750035,0.31813908,-0.7891244,0.9144653,-0.074905284,0.094690315,-0.41082248,0.15201962,-0.8140153,0.9998956,0.5389792,0.71522135,-0.10688555,0.3409325,-0.1686416,0.20431541,-0.99037,0.5911885,-0.42634788,0.1207251,-0.7119316,-0.18116161],
    [47,1,"NC(=O)N(O)C1C=CC(Oc2cccc(Oc3ccc(F)cc3)c2)C1",-0.63110846,0.056029804,-0.026419695,-0.118693314,0.1462203,-0.6610656,-0.5759413,0.44671434,-0.48665652,-0.2287456,0.26409462,0.27204657,-0.55203813,-0.67829454,0.24887905,0.3677146,-0.26151654,-0.28662124,-0.002226928,-0.050418925,0.73532563,0.026472488,-0.51559037,-0.65019846,-0.15946724,0.7393822,0.2972635,0.49945006,0.054418534,0.7659807,0.5229509,0.18763612,-0.15167736,-0.032467168,-0.12633714,-0.3059905,-0.28799424,0.2152504,0.9985753,-0.4542406,0.6492652,-0.011341835,0.19455211,0.4178741,-0.39869288,-0.014020506,-0.34105226,-0.17994815,-0.122615956,-0.62556404,0.7420772,-0.4647791,-0.27351686,0.8091927,-0.030601945,-0.32001385,-0.5585164,-0.364936,-0.190364,0.536466,-0.25270516,-0.20776267,-0.24977098,0.27625272,-0.18528631,0.16051055,0.14480148,0.20055665,0.2056403,-0.4115269,-0.7884351,-0.9030794,-0.4971731,-0.014614716,0.4987713,0.71063423,-0.09593915,-0.6543025,-0.5434521,-0.9905999,-0.46382278,-0.73920965,-0.9250556,-0.6391563,-0.49400246,-0.82597226,-0.5470439,0.06560968,-0.5577572,0.2207581,0.25092742,0.78131217,-0.047507428,0.3238158,0.99748033,-0.46242577,-0.22717473,0.15161835,0.22284248,-0.47343838,-0.2925453,-0.6240923,0.002322004,0.99218106,-0.99555254,-0.22302467,0.5658695,0.12881424,-0.9991929,-0.5046087,-0.78899276,0.08405463,0.4729018,-0.11471961,0.49963927,0.07205402,-0.007887691,0.7573286,0.97549987,-0.26664907,-0.60328585,0.7983306,-0.24917798,0.043175418,-0.65258235,0.35165113,0.32358947,-0.87946296,-0.29911664,0.99856114,-0.12735361,0.2126407,-0.060913626,0.38570195,-0.15200475,-0.7278564,0.06283988,0.5608145,0.012303769,-0.6906901,-0.9999986,-0.18866718,0.54709625,0.13708712,0.71714085,0.08571816,-0.23171385,-0.007651431,-0.9664915,-0.7763582,0.38882282,-0.52001834,0.63829714,-0.11871473,-0.3215616,-0.30239907,-0.4912952,-0.23111679,0.033606153,-0.23274969,-0.70051134,-0.3610785,-0.6424839,-0.17012465,-0.13705231,-0.11337639,-0.7917436,-0.20291193,-0.69923,-0.35059455,0.27362093,-0.040112756,0.63406765,0.60877264,0.5986504,-0.89635915,-0.16807185,0.110182926,0.18205278,-0.53544885,0.70555335,-0.9068831,-0.5046251,-0.112224825,0.7765796,0.21221136,0.2943448,0.34289542,0.033293646,0.031688068,0.06890515,-0.39690927,0.52561194,0.6326902,0.35352233,-0.6269282,0.39551273,0.28462848,0.2679072,-0.28081155,-0.058905642,-0.18535507,-0.043281086,-0.50455964,0.5936039,-0.25728384,0.05102956,-0.5508051,0.65531296,-0.9999334,0.5924586,-0.6340328,-0.2808196,-0.34924114,-0.5227949,0.73158664,0.7193309,-0.3948212,0.4880477,-0.2553001,0.6628074,0.51666003,-0.65106726,0.0866604,0.99997157,0.17000906,0.16047214,0.5393042,0.70057106,0.44232342,-0.5438896,-0.2271574,-0.30940098,-0.44156578,0.41077808,0.013290973,-0.25597212,-0.44545466,-0.091779575,-0.022669353,0.8449362,0.6273856,-0.3504599,-0.38640445,0.5377364,0.10358259,0.613622,0.5024654,-0.21541972,-0.6022363,0.10517402,-0.7345577,0.36940047,0.83285487,0.61393404,0.7585676,-0.81014425,0.57584065,-0.4482652,0.44417432,-0.15133885,-0.7830912,0.052204724,-0.3425103,0.30658892,-0.07716159,-0.15024954,0.4946597,-0.480888,0.17198677,-0.47294632,0.9996864,0.57442814,0.3947331,-0.06910812,0.7977134,0.35835603,-0.36252365,-0.7275806,0.36049727,0.2312869,0.99552923,0.29867166,0.22410055,-0.4767941,0.001318175,-0.14001894,-0.16083246,-0.93841463,0.16721459,0.42725405,0.8323194,0.055222407,-0.36967954,-0.71016985,0.29230747,0.9999988,-0.9475054,-0.004103089,0.4669649,0.15493852,-0.152375,-0.39488387,-0.48629835,0.035501495,-0.36818725,-0.9775352,0.33725226,0.83454376,0.18189433,-0.1591779,0.7591268,-0.20687382,-0.60019153,0.31273213,0.035928026,0.5595251,-0.6680398,0.94261044,0.28782728,0.24150953,-0.035643738,-0.011482774,-0.82488286,0.33129302,0.49558896,-0.06387454,-0.3646851,-0.5738421,0.28708097,-0.62462217,-0.76448804,-0.20568639,0.6651143,-0.33748052,0.006878379,-0.1089188,-0.23639068,0.36785445,0.45387337,-0.17950314,0.336801,-0.34318787,0.5689993,-0.4047104,-0.57652736,-0.4573328,-0.061989374,0.3069834,-0.89844215,-0.8908924,0.20283543,0.5973641,-0.03679263,-0.3745817,0.43570763,0.46178105,0.99973863,0.62207085,0.3773867,-0.33263692,0.5270892,0.4977955,0.05491292,-0.909545,-0.20813785,0.2336796,-0.32989034,-0.62930495,-0.05061453,0.0863198,0.6850412,-0.27222657,-0.24895437,0.054036766,-0.9827071,-0.61365724,-0.60641277,0.053744227,-0.33295825,0.17741539,-0.42151833,0.37002406,-0.39550236,0.30723086,0.359334,-0.25283903,0.4697962,0.7157622,-0.7014313,-0.62115884,0.51709354,0.34287962,-0.3874271,0.7180398,0.29624137,0.14168072,-0.030537965,-0.5204421,-0.09968978,0.87760764,0.30218145,0.07520171,-0.48324838,-0.5552964,0.06651092,-0.31262824,-0.7702741,-0.5886624,-0.39487836,-0.34331605,-0.49244827,0.1997227,0.34223628,0.12167621,0.24279222,0.9012488,0.045299355,-0.97290707,0.24980186,0.9997186,-0.5771619,-0.060393795,-0.9821125,-0.15587467,-0.75096697,0.12646325,0.20897722,-0.3153089,-0.1832283,0.17757018,-0.39538476,0.37895483,-0.31495485,0.014103983,0.16489346,0.59731203,0.37263343,-0.99998313,0.99999946,0.24411319,-0.47627333,0.37795547,-0.82117444,-0.78257954,-0.43958893,0.48694196,0.107109934,-0.40517852,0.17280862,-0.84083736,-0.5055843,-0.1219789,0.07203149,0.43599722,0.08539781,-0.013838137,0.7361382,-0.99974406,0.053949766,-0.27540338,-0.66855294,-0.110532194,-0.5941337,-0.54734415,0.15050921,-0.14557537,0.33814353,-0.5088187,-0.30319032,0.6603942,0.92327875,-0.13069125,0.67215616,0.5156725,-0.4760111,-0.09885637,-0.7089706,-0.19162405,-0.52114266,-0.24163805,-0.1684751,-0.9913171,-0.3324479,0.454749,0.05989569,0.2897192,-0.37432024,0.79135704,-0.33093625,-0.3802024,-0.031265564,-0.7488504,0.99726325,-0.38430485,0.2239607,-0.3046561,-0.01767944,0.49409157,0.99992347,-0.06820489,0.56112516,0.53300047,-0.3005899,-0.7033755,-0.30335268,-0.9978125,0.6048276,-0.39462036,-0.40954053,0.08494064,-0.025886301],
    [48,1,"CC12CCC3c4ccc(O)cc4CCC3C1CCC2O",-0.61864376,-0.26658213,0.42231375,0.53846556,0.5310119,-0.18567933,0.37648243,-0.095607854,-0.29649124,0.4004109,-0.8124726,0.3183606,0.1919095,-0.19138148,-0.1261421,0.7869296,-0.061906617,-0.6510709,0.6999353,0.1610504,-0.07973409,-0.3919025,0.04970624,0.082839034,-0.31643894,-0.13833082,0.1641208,-0.41532782,0.42210633,-0.39893293,-0.126112,0.4207662,0.31329963,0.48775402,-0.383289,-0.08274255,0.34074616,-0.569236,0.9969717,-0.79644924,-0.7451477,-0.21639666,-0.37391177,0.13052222,0.50821596,-0.83987826,0.30633548,-0.38634038,0.8076249,-0.4106531,0.5426033,-0.39383644,0.22882,0.45989576,-0.8687882,-0.2875915,0.18720853,0.5883756,0.23106223,-0.063775025,-0.36412752,0.037149068,0.5681611,0.43164435,0.47181383,0.5131249,-0.61799854,0.12188635,0.2891571,0.54818606,-0.38238594,-0.6591915,-0.31680283,0.7230591,0.07953737,0.64126724,-0.48456943,0.21002425,0.47072926,-0.99868983,-0.92676395,0.22037452,-0.9197295,-0.22455445,0.26360032,-0.915656,0.35676312,-0.4110046,-0.058599498,-0.4775998,-0.16086951,0.108882144,0.095674716,0.2591371,0.9782423,-0.4717362,0.6705594,-0.28831917,0.09876337,-0.22601959,0.2797938,0.02621593,-0.73556215,0.8681892,-0.9597123,0.6796523,0.48806438,0.28108376,-0.9996341,-0.20964824,-0.31025797,-0.52345914,0.41252238,-0.2870216,0.71205765,0.11017306,0.06513583,0.20180108,0.99180305,0.78264976,0.01904419,-0.087131225,0.21229625,-0.2816615,-0.014760939,0.32549936,-0.3100571,-0.26779708,-0.34511513,0.9999379,0.24684274,0.10205313,0.15033287,-0.086732835,-0.13844517,-0.35443774,0.64797026,0.5542002,0.26621473,-0.4646386,-0.9996683,0.0676228,0.95201415,-0.5628953,-0.09198829,-0.3235948,-0.6450077,-0.43204793,-0.6457665,0.18650246,0.5582018,-0.71752834,0.8736724,0.47724986,0.103392355,-0.66518503,-0.7843941,0.56011933,-0.3002239,0.19841124,-0.91760606,-0.06268173,0.2769888,0.24841915,0.740981,-0.12920864,0.45554316,-0.19097556,-0.3550366,0.6508549,-0.5525462,-0.10364693,0.4903453,-0.055575997,-0.6386276,-0.9852673,0.6229645,0.4758491,0.16867882,-0.08878681,-0.06145756,-0.09544702,0.7199052,0.59755474,-0.075727955,-0.1946886,-0.26130193,-0.3146823,0.002276701,0.6284249,-0.2937429,0.40241972,-0.45117107,-0.1499069,-0.14586776,-0.12270821,-0.3324234,0.020687072,0.21036312,-0.13963576,-0.28455314,-0.11935286,0.30162343,-0.032763876,-0.07868431,0.5576354,-0.16317026,-0.70972526,0.28480616,-0.9999254,-0.47212565,0.2993897,0.11240024,-0.7364843,0.4778403,-0.637998,-0.31994918,0.6662101,-0.5025309,-0.515741,-0.18051471,0.51732004,-0.7824947,-0.39818084,0.99999714,0.1731507,-0.14042878,0.22790553,-0.20196272,0.6079623,-0.20252796,-0.7361605,0.4864894,0.05003067,0.044066023,-0.03985871,-0.6786094,-0.08710989,0.3908858,0.18002191,0.77857876,0.24032377,0.9250116,-0.48026022,-0.52906996,0.61883587,0.17412508,0.038674545,-0.28755817,-0.7019192,-0.28506956,-0.37326443,0.06360254,0.14086503,0.046691243,-0.6874947,0.19071257,-0.23050334,0.1042562,-0.21280974,-0.6633408,0.6492184,-0.32334194,-0.8477371,0.48865405,-0.015267492,-0.06512181,-0.7784293,-0.7935355,-0.05135631,0.17683229,0.9960487,0.039014325,-0.21555544,-0.53433895,0.6345448,0.051306866,-0.44209573,0.46067166,-0.40546474,-0.001504442,0.9975605,-0.16107346,0.6531385,0.006096495,0.04332421,-0.11941523,0.25670007,-0.8403925,0.14287779,-0.098871276,0.96565723,0.18295357,0.17284665,0.5854558,0.696982,0.99999195,-0.99639964,0.5049918,-0.17701925,-0.4388683,-0.47768867,-0.09448181,0.02570929,-0.6616238,-0.9861039,-0.69573736,0.23940715,-0.42340568,0.07471911,0.5420922,-0.58071154,-0.17429088,-0.36368626,0.79830056,0.42341986,-0.13723248,0.08887312,0.9313879,0.5459978,0.47198063,-0.16868207,0.006932162,-0.60555315,-0.7172433,-0.11178554,0.035998046,-0.85053927,0.17455745,0.30502,0.44994932,0.054733515,0.6940467,-0.52737874,-0.067338295,0.72191304,-0.18665093,-0.14307956,0.4177399,-0.1716746,-0.19805582,0.06429676,0.7052462,-0.2027126,0.1337346,0.7916782,-0.37340787,-0.5618419,-0.007178095,-0.43594706,-0.973907,0.5492297,-0.277331,-0.2836856,0.49180833,0.575346,0.5222475,0.999754,-0.3234998,0.40567577,0.09812166,-0.17733909,0.048182048,0.5879032,-0.9177892,0.18087922,0.34339237,0.38453025,0.33901414,0.32255343,-0.27327275,-0.23616154,0.6673058,0.52529895,-0.3340994,-0.99998623,0.67482555,0.74739563,-0.33657417,0.021911437,-0.6158968,0.30855748,0.094509505,-0.44894695,-0.63274074,-0.43422985,-0.37592953,0.18325853,-0.16792937,-0.85582525,-0.11096326,0.42224008,-0.10512904,0.19638479,0.30638555,0.44556177,0.09245935,-0.19506729,0.6928273,-0.43953905,-0.46781233,-0.075441964,-0.40261406,-0.25568533,-0.026082136,-0.7254483,-0.46862155,-0.77632135,-0.39207813,0.49324733,-0.05788447,-0.5149047,-0.14915177,-0.18204875,-0.03028388,-0.48390323,0.91187483,0.0653523,-0.9845102,-0.27472517,0.9982116,-0.6657847,-0.33497533,-0.9872164,0.52491784,-0.12859932,-0.4416342,-0.52230203,0.31300783,0.66268593,-0.6453678,-0.84461665,-0.33515382,0.04382717,0.35703963,0.39919817,-0.19978245,-0.000950834,-0.9998785,1,-0.6896962,-0.18126549,-0.4652908,0.9756567,-0.4616801,-0.6320067,0.78194803,-0.2138138,-0.2471964,0.14740503,-0.54198647,-0.53577465,-0.06404044,-0.6450806,0.4339585,0.14273243,0.35705137,-0.1144229,-0.99979234,-0.7934275,-0.3751336,0.4970092,0.18267559,0.37097594,-0.9810269,-0.02212187,-0.78933847,-0.4911525,0.18739067,0.16127437,0.17395565,0.70250666,-0.2806451,0.46348602,0.50093484,0.5403558,0.36613202,-0.78174186,0.28133497,-0.012354911,-0.3307017,-0.54376674,-0.9443141,0.6786648,-0.49726534,0.4248139,-0.38569152,-0.7394445,0.2700818,-0.9020669,-0.70938283,-0.3367537,0.08004041,0.97609067,-0.15109298,0.34542757,-0.53325903,0.71599877,0.11212636,0.99992126,-0.16656409,-0.49543607,-0.12838127,0.5321655,-0.3064068,0.22296214,-0.9955436,0.06762299,0.34339327,-0.18527237,0.72980297,0.34965062],
    [49,0,"CCSC(=O)N1CCCCCC1",0.13603567,0.11182831,-0.2565913,0.10969567,0.4777359,-0.05130899,-0.18641122,0.09154691,-0.46838343,-0.3516767,-0.37661368,-0.17869882,0.007878657,-0.23502296,-0.013735892,0.55714715,0.28659946,-0.0757936,0.034335442,-0.1429018,0.5631049,-0.69820994,0.18874599,-0.07769162,-0.013033926,0.55597585,-0.0505236,0.021400064,-0.32754928,-0.41466206,0.4028785,0.44644445,-0.15163983,-0.4125985,0.33499986,-0.3662908,0.6120871,0.49480355,-0.32159796,-0.8834257,-0.9961288,-0.4383495,-0.26772466,0.3733505,-0.21025266,-0.99422747,0.32622865,0.57132614,0.9734768,0.22272782,0.40132102,0.3926505,-0.17004862,0.07375904,-0.88071996,-0.013953188,0.593298,0.9686615,0.22865303,0.20330612,0.28403103,-0.12414072,0.30653644,0.22288448,0.357611,0.43529353,0.44136032,0.68679774,0.09855411,0.2727544,-0.033760644,-0.9853214,-0.1887054,0.79960483,0.50415474,0.031376008,-0.7652885,-0.02686365,0.55107623,-0.9997756,-0.050126445,-0.4348633,-0.38874316,0.01413817,-0.22571021,0.27891007,0.73526514,0.44215462,-0.14031614,0.40848067,0.08100333,-0.26140255,-0.11974956,0.12237288,0.9599435,-0.29492748,-0.003943206,0.3716201,0.12367466,-0.26655263,0.40614426,-0.47265342,0.23769204,0.36850008,0.9194597,-0.05915299,0.63291365,-0.21665677,0.99342775,0.15992261,0.22548008,0.058083635,-0.34852904,0.36525074,-0.393344,0.3633819,-0.31369933,0.3385704,0.9989596,0.05349408,-0.4309173,0.53418785,0.28247046,0.03447813,-0.020164073,-0.09470718,-0.2196686,0.04115791,-0.23235542,0.9990968,0.10352301,0.61273676,-0.30557472,-0.38466483,0.4068656,-0.9561469,-0.23220447,0.09521641,-0.24807152,-0.5027293,-0.9918894,-0.22416502,0.98210365,0.08431738,-0.316492,-0.18319924,0.012374469,-0.19578315,0.99193114,-0.13062371,-0.4418078,0.2898558,0.39669725,0.22704916,-0.5148037,-0.37652186,-0.13933544,0.9990193,-0.14109631,-0.93204725,-0.98812014,-0.48717946,-0.07101738,0.18941207,-0.51545876,0.10891514,-0.09681594,-0.61903524,0.28904906,-0.09552597,-0.44430968,-0.41170564,0.07671785,0.02553532,-0.3064283,-0.9238977,0.88924265,-0.18164547,-0.48439017,-0.03073955,0.4690319,-0.31448925,0.5168415,0.62869173,-0.9685531,-0.5782795,0.2315093,0.44471818,-0.26583394,0.56376404,-0.43821114,-0.10299881,0.4828869,0.48384917,-0.078498386,-0.46684575,0.33643737,-0.8863598,0.45683306,0.51581705,-0.020883484,-0.5317977,0.08201925,-0.19575638,-0.20080024,0.5197557,-0.39432445,-0.51128155,0.09674387,-0.9513321,-0.18782617,-0.15387902,0.18432651,-0.22276807,0.30524752,-0.33526054,-0.2319373,-0.47374612,-0.52510476,0.13453087,-0.14610223,-0.24650896,-0.5192725,-0.067476116,-0.92088693,-0.18768844,0.40462148,-0.49367416,-0.0887312,0.12425111,-0.46440488,-0.23911181,0.3044869,-0.35807925,0.09804213,-0.20546143,0.018633053,0.09306849,-0.34714025,-0.5080368,0.8673942,0.05599445,0.37224996,-0.3000862,-0.49475378,-0.4583273,0.6262807,-0.48475647,-0.6148539,-0.18481717,0.6534086,-0.9970105,-0.6532496,0.3008619,-0.34606215,0.5426271,-0.6192936,0.18360688,-0.27416787,-0.5682707,-0.13951033,-0.08616138,0.4868839,-0.39043278,-0.31485078,-0.343698,0.05260936,0.011049288,0.63706124,-0.3603411,0.062066503,-0.029129181,-0.12047197,0.003941776,0.13599804,-0.07621835,0.5920787,-0.5777312,-0.532506,0.7082386,-0.068768114,0.9993323,-0.16955064,-0.003357524,-0.6190219,0.064351626,0.11081925,0.62847,0.9602637,-0.28094295,0.26090103,0.99952054,-0.27574158,0.3619832,0.11596412,0.07161586,0.9982509,-0.9408374,0.26424333,0.45804697,0.04848318,0.3622881,0.44104028,0.044169724,-0.3182755,0.18235807,0.9961412,0.4376827,0.24311177,0.3792885,0.30065492,0.108854346,-0.28177592,-0.27933693,0.75115025,0.17621832,-0.1562303,-0.65016496,-0.99998766,-0.44656938,-0.27623564,0.5947243,0.001806838,-0.621207,0.29178715,-0.012745689,0.03951961,-0.9477549,-0.12658952,-0.11316197,0.14754643,0.558645,0.09856796,-0.07923564,0.35690576,-0.027734092,-0.2675865,-0.72085655,0.1137154,-0.50548637,0.5296798,0.7170806,-0.04620648,0.86529297,0.42433915,-0.13239303,0.46745172,0.33068275,-0.1878885,0.91486347,-0.9950045,-0.21200794,0.6265181,-0.20140286,-0.000507485,-0.29551804,0.27017903,0.99853504,-0.8132645,-0.4867927,0.077141896,0.12238934,0.41493592,-0.35423028,-0.40654147,-0.42426738,-0.43158484,-0.75463605,-0.68369937,0.51313823,-0.036611218,-0.31914744,-0.20591569,0.900142,-0.104048416,1,0.0848702,0.21758609,0.25783536,-0.15553065,-0.61575294,-0.005523586,-0.031075777,0.20039023,0.7111342,0.24828888,0.46384224,0.8710518,0.30997074,-0.57621235,0.1164344,-0.36881575,-0.121127956,-0.72163796,0.08090021,-0.42758346,0.15743776,0.03644853,0.563325,-0.20813638,-0.79314154,-0.4798654,-0.17894827,0.039634388,0.19117358,-0.43386686,-0.26260105,-0.1507291,0.28235486,-0.18086147,0.1720785,0.25383094,0.048558075,0.1351495,0.21862753,0.32680327,0.9999998,0.12678674,-0.66249937,0.39954114,0.99782646,0.11154663,-0.6115609,-0.999958,-0.39997613,-0.2515325,0.15747818,0.029142136,-0.6004691,0.31244448,-0.03584991,0.16195272,0.2758166,0.4634032,-0.4218241,0.25071678,0.38098034,0.13444765,-0.9998214,-0.99884945,-0.99119174,-0.18660766,0.21581063,-0.072930075,-0.51560307,-0.048889484,-0.5392742,0.60774004,0.011391765,-0.12162309,0.31024036,-0.052346885,-0.24869457,-0.59744287,0.26432645,0.30081177,-0.1971719,-0.98418754,-0.99979943,-0.38183278,0.2234415,-0.019181468,0.17294337,0.14832437,-0.9816117,-0.645814,0.20705467,-0.22342199,-0.13182816,-0.59077626,-0.11005928,0.52067024,-0.029026173,0.878591,0.48890427,0.4084225,-0.07782014,-0.39502653,-0.082103565,-0.20417894,-0.35796386,-0.17781661,-0.1821636,-0.38849428,-0.021970876,0.2362147,-0.5452044,-0.40878484,0.12164241,-0.9496163,-0.17122766,0.17214663,0.24092142,-0.8501989,0.49606,-0.41856715,0.3978646,-0.40538442,0.30863827,0.9995375,-0.24195346,0.37419373,-0.010434214,0.57009447,-0.26989183,-0.22659652,0.007545752,0.5381089,0.2318529,-0.15647334,0.47217593,0.30177763],
    [50,1,"CON(C)C(=O)Nc1ccc(Cl)c(Cl)c1",-0.79684585,-0.17946658,-0.08367757,0.5357994,-0.13611224,-0.7904157,-0.035796203,0.019410448,-0.40727013,-0.06435015,-0.49193713,-0.2920627,-0.20142266,-0.48963353,0.41560233,-0.39404318,-0.019438207,-0.2726302,-0.063270316,0.253254,0.502041,-0.5273955,0.47696772,0.030800458,0.42289403,0.6829236,0.38804504,0.27471069,-0.24274641,0.27016866,0.39257216,0.38306293,-0.027394984,-0.14995791,-0.029806346,-0.08362041,-0.24202493,0.5248259,0.84412783,-0.8819932,-0.9900052,-0.059107244,-0.54799336,0.25825864,0.3366736,-0.98865455,0.2568792,0.17759672,0.822496,0.24773414,0.5237907,0.0968504,-0.18799476,0.08117207,-0.6443962,0.58377194,-0.72190934,0.8417718,-0.1113562,0.5757387,0.33723128,-0.39099106,0.15143314,0.2325044,-0.08129473,0.4292171,0.17648423,0.16340913,0.057334483,-0.4298425,-0.79826903,-0.9836225,0.3195392,0.078495614,0.56207514,-0.0520207,-0.67139703,-0.41878885,0.40957877,-0.99879265,-0.34890616,-0.13246265,-0.8377299,0.34003463,-0.39648435,-0.22921067,0.17175028,-0.062153816,-0.58097494,-0.28170866,0.000740964,0.040873136,0.73613095,0.5001061,0.99348074,-0.4657995,-0.03596821,0.06911287,0.16669989,-0.40624237,0.45352605,-0.3657604,0.563575,0.6172948,0.22319613,-0.37419626,0.49112335,-0.009800666,-0.82887167,-0.31309715,-0.008904177,0.16949022,-0.21917571,-0.28628668,-0.090648934,-0.22745062,0.4269641,0.6194733,0.9993947,-0.3643646,0.3103363,-0.17119318,-0.29758543,-0.05331741,-0.3151076,-0.1649146,-0.09688952,-0.005324455,-0.33770877,0.998979,0.23364712,-0.03275404,-0.04622261,0.10780951,-0.106703125,-0.9623521,0.5952196,0.27842426,-0.67142767,-0.073941536,-0.993708,-0.0141433,0.9723746,0.077073045,-0.36761212,0.38622606,-0.03798978,-0.029429104,0.92953545,-0.6965351,0.3182362,0.71933603,-0.012289194,0.32419857,-0.55496866,0.124001995,-0.34029233,0.9957105,-0.28680614,0.30436146,-0.98339456,-0.38310146,0.07319479,0.442645,0.3743203,-0.2563036,-0.15982845,-0.22729442,-0.5704246,-0.033275947,-0.13194716,-0.49617395,0.41339412,0.4667436,-0.19512053,-0.93736625,-0.7550068,0.22923473,0.046991866,-0.015826982,0.6733802,-0.51675457,0.1887544,0.068306506,-0.81846,-0.62110007,0.39607412,0.54446477,0.4412312,-0.3680499,0.118931845,-0.097980104,0.41010964,-0.17768757,-0.25310346,-0.2512161,-0.05487783,-0.81794685,0.24008203,0.28990704,-0.5502268,-0.33825567,-0.583266,-0.57028157,0.3121914,-0.38496903,0.042767707,0.1734946,0.13602161,-0.99475265,-0.1317491,-0.2716848,0.008395221,-0.02151916,0.045915835,0.43728665,0.051337782,-0.27131912,-0.121109165,-0.054684795,0.35092226,-0.5564429,-0.43847567,-0.2140405,-0.90197337,-0.37980792,-0.21027434,0.20614634,-0.090571076,0.25630134,-0.1382431,0.12321186,-0.10023306,-0.3383887,0.40633273,-0.46379268,-0.3876895,-0.09054546,-0.40851918,-0.022795685,0.8035705,0.3449321,0.06653137,-0.6518045,0.47560728,-0.31753236,0.56722057,-0.3427937,-0.5447904,-0.43991417,0.7468317,-0.99858,0.22112371,-0.026634878,-0.16000842,0.39412794,-0.37685123,-0.39565918,0.14919938,-0.4744818,-0.24358985,-0.0635367,0.2559439,-0.408729,0.6080671,-0.31796515,0.04907123,0.36605996,0.31105015,-0.23528345,0.21842079,0.703659,0.45952207,0.44774267,-0.5360204,-0.5860769,0.38295266,-0.39630067,-0.60169584,-0.029397808,0.12102856,0.9996738,-0.121423215,-0.028264472,-0.41468474,-0.3737447,-0.3291626,0.07461337,0.03337935,-0.021864695,0.058544204,0.99925965,0.38295254,0.55948234,0.5277838,-0.008529638,0.9961748,-0.9291304,0.3546785,0.28615543,-0.46294716,-0.33877015,-0.10907918,-0.02348613,0.05064771,-0.12996782,0.9591758,0.3300392,0.5600872,0.24745938,-0.24403283,-0.40215245,-0.68796366,-0.19183038,0.7327473,-0.5786933,-0.19341892,-0.001435579,-0.9890724,0.33113134,-0.21186173,0.2182859,-0.018882677,-0.38899404,-0.19007003,0.21080382,0.039413754,-0.9401146,0.05610919,0.2985696,-0.66531277,-0.3339721,-0.06990889,-0.25290912,0.27924538,-0.21569294,-0.20477732,0.14143117,-0.3880009,0.5183213,0.30892587,-0.35755715,-0.21256037,0.49043927,-0.35977677,-0.014033208,-0.59384584,-0.26114082,-0.033750076,0.6198073,-0.99524164,0.30440587,0.26444674,-0.37855536,-0.21841215,-0.30809206,-0.17783374,0.99956185,-0.30405167,-0.6680387,-0.1957025,0.45976985,-0.17999716,0.10852566,-0.81850064,-0.8449272,0.34449935,-0.51701987,-0.46241432,-0.016359797,-0.09023117,0.3293359,-0.18843657,0.72708935,0.26312548,1,-0.12571436,-0.63594615,0.5795831,-0.22313227,-0.7698203,-0.17762895,-0.053296395,0.15476245,0.44565162,-0.3509336,0.1831873,0.15503924,-0.048441637,0.54431736,-0.31157863,0.45964664,0.035344973,0.093571365,0.6762415,-0.6092635,0.29495418,0.1244184,0.13487805,-0.16253954,-0.4508185,-0.67602324,0.20985648,0.105198525,0.04020366,-0.20877132,-0.450213,-0.18337205,-0.11517033,-0.17153402,0.08108352,0.070437446,0.27079478,-0.17713942,-0.07749086,0.4200277,0.99998194,-0.27300167,-0.9655105,0.4849829,0.99988127,-0.24543096,-0.6074896,-0.99921983,-0.36782715,-0.13713118,0.30502248,-0.6883245,-0.2895307,-0.4269394,0.01982504,0.3203999,-0.20996667,0.119326994,-0.09828374,-0.066357955,0.22835526,0.32851326,-0.9999901,-0.99920905,-0.97887653,0.056099847,0.32510093,-0.45492643,-0.20484819,-0.5469144,-0.8415868,-0.044655286,-0.015691042,0.5154369,-0.58927673,0.16623287,-0.061118938,0.079565145,0.15302469,-0.5169396,-0.08511774,-0.9470144,-0.9999593,-0.07757401,0.61989313,-0.21126604,0.15502137,0.05023485,-0.9680402,-0.16977242,0.47392735,0.3236389,0.28689542,-0.7167134,0.79846495,0.932535,0.22441265,0.90346104,-0.11442165,-0.13670158,-0.3936647,-0.35767722,-0.37975708,-0.14329024,-0.6131022,-0.29563767,0.12152175,-0.09256841,-0.11593231,0.024270961,-0.3264276,-0.6740715,0.49098703,0.66761875,-0.0189929,0.18041065,-0.054582328,0.18077897,-0.30621475,-0.054882444,-0.13817136,-0.6757519,0.7299417,0.99997205,0.06672584,0.5519503,0.32635105,0.51388454,-0.3063922,0.1099826,-0.6790851,0.33947888,-0.14740597,0.5029812,0.39191145,-0.14593716],
    [51,0,"Cc1ccc(N=CN(C)C=Nc2ccc(C)cc2C)c(C)c1",-0.6856567,-0.54409045,0.1921508,0.03456505,0.24463712,-0.69946396,-0.38275382,0.5104125,-0.69162035,-0.5716243,-0.6942997,-0.11977574,0.6410581,-0.063534334,-0.024930803,-0.7228456,0.17461748,-0.46263966,0.60579586,-0.042748276,0.17755245,-0.46912462,-0.005483873,0.3195794,-0.2763602,0.36018246,-0.30466557,0.55783415,-0.004711585,0.014365024,-0.6086897,0.043007355,0.13864954,-0.3718134,-0.15593457,0.6980911,-0.1972496,0.5209006,0.9968407,-0.85058814,-0.736226,-0.1728988,-0.75117666,0.13040787,0.66588277,-0.52331054,0.19725886,0.07033254,0.9937018,-0.20178232,0.27383706,-0.15679456,0.84365064,-0.68173355,-0.73506606,-0.5453195,-0.64899117,0.03275283,0.41226164,0.37293938,0.20893852,-0.24635918,0.1076705,0.05914198,-0.5063993,-0.15833248,-0.74406075,0.36651474,0.54578406,0.6326605,0.19213387,-0.3169964,-0.24575432,-0.4679463,0.91159785,-0.5785615,-0.2335172,-0.5213877,-0.04661437,-0.99458206,-0.0963297,0.18968542,-0.83081007,0.16158971,-0.7234433,-0.9559753,0.20219278,-0.10481166,0.32083336,0.048509914,0.44517255,0.3366372,0.4122798,0.7335331,0.9508983,0.43633568,0.14969899,0.47276393,-0.08541951,0.15968947,-0.9033536,-0.1861977,0.34869388,0.95658726,-0.97546726,0.10334074,-0.80004036,-0.67512006,0.99155813,-0.5925611,-0.07381774,0.8538743,0.18176329,0.4122876,0.23351452,0.63836265,0.38526803,0.6481111,0.9886248,-0.68326044,0.5335147,0.29713556,0.45601436,-0.5051055,-0.50677174,-0.21570157,0.60736746,0.5251144,0.62094027,0.999936,0.5391466,0.35446194,-0.19586655,-0.20150515,0.36211428,-0.96241146,-0.29561538,0.57146686,-0.47874957,-0.8153694,-0.99987596,0.40457433,0.9522601,-0.23934405,-0.2939373,0.58374196,-0.27806777,0.16547681,-0.8605575,-0.05942892,-0.060773756,-0.5992256,0.22978222,0.14168453,-0.25110096,0.73997056,-0.085744195,0.5292648,-0.47423652,-0.96996,-0.7805062,-0.027773352,-0.46072865,-0.33693442,-0.26057637,-0.21177457,-0.08264486,-0.5150359,0.11993707,-0.26450446,0.045079663,-0.49441627,0.14785449,-0.004523859,-0.55301106,-0.90394276,-0.7345379,0.329024,0.07252466,-0.67117786,0.5872688,0.5124346,-0.48712385,-0.081311636,-0.10784179,-0.6989382,0.04363143,-0.07392338,-0.11508305,-0.07933979,-0.36645553,-0.18818021,-0.40162134,0.67402124,0.20044126,0.2476866,0.30858454,-0.5868436,-0.12689942,-0.5729301,-0.38519233,-0.90055686,-0.66572803,-0.06484937,-0.49295688,0.6646563,-0.61002505,-0.57898074,0.097718745,-0.99974996,0.580059,-0.31725258,-0.057589464,0.69704634,0.45697737,-0.30009612,-0.03503853,0.1234271,0.3364425,-0.32123613,-0.002420519,0.29793534,-0.92105263,0.49416965,-0.99489635,0.5919195,0.34329972,0.48157397,0.40071285,0.3649025,-0.34940234,-0.81474006,-0.06780555,-0.3138363,0.15992336,-0.59531194,0.66551435,-0.16166912,-0.02002762,0.000212608,0.78088474,0.30616063,-0.03287145,-0.8191824,0.21638036,-0.110052,-0.38425842,0.49481767,-0.45124307,0.26342013,0.77029973,-0.9787918,0.5419481,0.7911948,0.49918044,0.04680345,0.72474295,-0.30137202,-0.22282694,0.61616975,0.21210715,0.17369105,-0.42049792,0.5812953,0.4535424,0.23678501,-0.38061798,-0.7666274,0.93707705,0.8295467,0.302327,0.998175,0.12966916,0.12564947,-0.2849211,-0.64209104,-0.51438,-0.85102636,-0.7025859,-0.3732714,0.46536765,0.9983105,0.67572373,-0.3356599,0.114261895,0.54069066,-0.12329876,0.9477008,0.8020547,0.7137538,-0.70248526,0.9633642,0.29567787,-0.3237245,0.62274253,-0.23402295,0.9999307,-0.9952242,0.5125856,-0.48809597,-0.25954247,0.10668467,-0.52387846,-0.69114536,0.6845733,-0.8384612,-0.8589868,0.74610865,0.8774618,-0.768592,-0.3754679,-0.03529585,0.3179558,0.17404078,0.9237797,-0.38943377,0.5125211,0.47660384,-0.9999761,-0.19213866,-0.8096429,0.20982884,0.27925563,-0.26135796,-0.66841865,0.3737934,0.7963095,-0.83781266,-0.22277057,0.60669935,-0.5443138,-0.25111553,-0.36646652,0.18793559,0.5233872,0.90279645,-0.5909201,-0.15696616,-0.8289423,0.32828775,-0.20989557,-0.23580408,-0.073326334,0.09574545,-0.11318561,0.02099346,-0.10430533,-0.084188655,-0.67330784,-0.59105384,-0.9700113,-0.17517672,-0.6284116,-0.09188528,0.5006902,0.19166467,0.56938255,0.9990311,-0.19857812,-0.74330306,-0.20735586,0.4693352,-0.43217298,-0.03181186,-0.8591093,0.46305284,0.71318245,-0.08139476,-0.7687318,0.32760304,-0.24052666,0.7633056,-0.4359328,-0.35031372,-0.43330973,0.9989815,-0.14813526,0.07073608,0.29558298,0.19369738,-0.4782431,0.9193654,0.6647144,-0.39224762,-0.8040384,-0.1861623,-0.45103526,0.22634912,0.5287445,0.31597686,-0.3668796,0.19524282,0.4029622,0.025570592,-0.3251184,-0.71831703,0.2617293,-0.7785591,-0.32234982,-0.5965734,-0.5147619,-0.41850737,0.4737913,0.063127294,0.5101987,-0.4624515,-0.44272617,-0.40387797,0.17327043,-0.026573585,0.7960698,-0.20883453,0.20995326,-0.09239866,-0.7027926,-0.29856753,0.9999999,0.86701775,-0.9851174,-0.08743895,0.9990344,0.51322585,-0.681141,-0.99996847,-0.15328573,-0.7307053,-0.38435072,0.50048804,-0.7630441,-0.83202934,-0.3810294,-0.436669,-0.38710472,-0.72543526,-0.29537138,0.22710845,0.056922995,0.5941734,-0.9999623,0.9855624,-0.44694075,-0.50372136,0.8688005,-0.3307036,-0.7919362,-0.44875005,-0.22196269,0.39412937,0.46333954,0.005548285,-0.7255476,-0.051724005,0.13461517,0.30726293,0.20511048,0.42990187,0.12952535,0.38470972,-0.99983627,0.5736617,0.31623945,-0.060547393,-0.193303,0.33420405,-0.9875535,0.28020996,0.3928656,0.09709263,0.64030784,-0.115380675,-0.7246966,0.9765572,0.40458518,-0.4533343,0.5107517,0.46700495,-0.17688003,-0.3376333,-0.082117654,-0.544156,-0.007110301,-0.7474471,-0.99547505,0.018917775,0.2742369,0.4710351,0.65290093,-0.32022747,-0.042949867,0.5084729,0.4810153,-0.13314056,-0.13807306,0.99377024,-0.32942924,0.50819033,0.43560576,-0.14879853,0.6182063,0.999951,0.5198661,0.6177751,0.4504487,-0.43037164,0.72079647,-0.40565068,-0.9934553,-0.008763617,0.26525074,0.5661193,-0.24628517,0.062083375],
    [52,1,"CCCCCCCCCCCC[N+](C)(C)C",-0.5016134,0.028546277,0.3627091,0.36165342,-0.2875648,0.063233085,-0.39957306,0.118425265,0.15155244,-0.35034817,-0.8539641,-0.038423836,0.27433035,0.019912519,0.039609447,0.32579693,0.38173538,-0.29993793,0.03351692,0.36283007,-0.7794503,-0.7475914,-0.25517702,0.005489409,0.8323994,0.16468364,-0.16694456,-0.16204424,0.74295425,-0.29379907,0.14041196,0.7318826,0.7308798,0.29801753,0.01625869,0.24148537,-0.01836672,0.7336156,0.8233759,-0.8792399,-0.9915074,-0.041305806,-0.2149709,-0.30424222,0.087728575,-0.98837656,0.1573406,0.17781587,0.9993836,-0.15355593,0.46469188,-0.17431298,-0.24201731,-0.31881183,-0.9335303,0.29054895,0.8996856,0.9278105,-0.33949593,0.1331484,-0.21657369,-0.18201487,-0.18767317,0.58956647,0.57131433,0.46928233,-0.540861,0.1975184,0.5920455,0.008783174,0.8827953,-0.48655218,0.002788372,0.8759054,0.91828024,0.55240667,0.3637601,0.4500814,0.35178748,-0.9999344,0.2922832,0.46231142,-0.92485684,-0.60261333,0.43265787,-0.8728565,0.007510154,0.29644394,0.19931725,-0.5266057,-0.5534134,0.102106646,0.32350504,0.054048147,0.495219,-0.67708415,0.69757026,-0.120484255,0.21170487,-0.73306745,0.4115562,0.5790456,-0.07437915,0.8698604,0.27558765,0.77627975,0.29997057,0.1938127,0.9951801,-0.71345836,0.24372002,-0.005280431,0.76271856,-0.16278255,-0.7156392,0.38310048,0.013635831,-0.14048521,0.99587727,0.9061366,0.13389571,0.6019967,0.64411753,0.09329139,-0.19418265,-0.08218656,0.36852604,0.12593913,0.07784499,0.99998504,0.37371388,0.5569122,-0.020937048,0.4094039,0.06445715,-0.8743371,-0.7084179,0.5736502,-0.13508515,0.003096643,0.99925715,0.43838343,0.99547786,0.58985585,-0.7159497,0.17319603,0.8032221,-0.10953791,0.8931559,0.38295552,-0.73899114,-0.9373637,0.7609278,0.7988417,-0.20633782,0.41969875,0.14566095,0.9919419,-0.12081028,-0.93054223,-0.9630105,-0.48277384,0.100830354,-0.116763964,0.52478355,-0.44935003,-0.12032344,-0.21167378,-0.42742726,-0.07015029,-0.35540724,-0.21207385,-0.09818884,0.17933764,-0.02447317,-0.98800826,-0.39362723,0.21454135,-0.6005854,-0.32398787,-0.17646979,0.852144,0.4341515,0.52976406,-0.9187239,0.10240081,0.16798396,0.49688545,-0.13166381,0.4824207,-0.8430513,0.5897723,-0.42977926,0.7782296,0.13043238,0.47431785,-0.06565009,-0.6974673,0.61975175,0.501182,-0.072308436,-0.45679477,-0.29953313,-0.39418003,0.37721524,0.43618456,-0.14311033,-0.69938236,-0.004740202,-0.9982427,0.13982432,0.008912732,-0.03331648,-0.5386829,0.6490827,-0.045177594,-0.22950596,-0.12255687,0.08291832,0.42605364,-0.48416263,-0.26009908,-0.7102259,-0.16144219,-0.9772356,0.6568867,0.17285062,-0.458891,0.017020073,-0.12002179,0.3333558,0.33844468,0.22759922,0.30234924,-0.5699127,-0.14543274,-0.46988228,-0.17273977,0.6004956,-0.000758173,-0.9493251,-0.36391708,-0.3596552,0.52845913,-0.88808554,-0.61604506,0.09717035,0.16080883,-0.031648237,0.40417734,0.20214863,-0.9998657,-0.37991837,0.73168695,0.26860827,0.5183861,-0.58141077,0.4957682,0.17712393,-0.5893988,-0.5415584,0.810844,-0.5897646,-0.4557733,0.672673,0.5086849,0.48663962,-0.75361925,0.9792446,-0.4300018,-0.43055233,0.58897907,0.015592516,0.2167928,-0.15015893,-0.7168548,0.6875469,-0.7497076,0.15102026,-0.39927167,-0.33242545,0.99959433,-0.42951885,0.5164066,-0.599802,0.17718637,0.049102,0.96837753,0.9576958,0.5098494,-0.28217965,0.9978282,0.027484294,-0.03829642,0.13818207,0.7263005,-0.998218,-0.9987859,-0.2856765,-0.33832794,-0.2906124,-0.34410617,-0.30384752,0.17107108,-0.38663116,-0.95083296,0.9051738,0.26610643,0.3155837,0.6489375,-0.46835658,0.43527663,-0.4996468,0.43334812,0.97024184,0.21948858,0.4956831,-0.30200392,-0.99999326,0.12361319,-0.09078525,0.7639888,0.21871611,-0.7052726,-0.21240854,-0.6756434,0.32509074,-0.9574513,0.2747075,0.7564574,-0.32121924,0.059720356,0.46883404,-0.4603325,-0.06160165,0.9731663,-0.23648614,-0.2180221,0.3621006,0.37395144,-0.23899198,0.019688534,0.21754737,0.5150093,-0.11541841,-0.030474832,-0.008869363,-0.37844232,0.3109178,0.76293224,-0.99687076,0.12954,-0.38516033,-0.21206985,-0.24372959,-0.022224173,0.22759764,0.9999183,-0.23526339,-0.72561175,0.05437552,0.1345681,0.11591942,-0.6368702,-0.6482732,0.22998206,-0.4678371,-0.81901896,-0.7555125,-0.6197704,0.23770273,-0.5824795,-0.8922608,0.7936733,-0.7542025,1,-0.33222198,-0.43921524,0.38827688,-0.1525161,-0.13965921,-0.02116153,0.8502897,0.06747202,-0.078122295,-0.74190277,-0.09109358,0.003390053,0.24115776,-0.45912287,-0.4341039,0.13381183,0.06277538,-0.5614196,-0.41777027,-0.9844774,0.6755696,-0.47758198,-0.73709553,-0.6636585,-0.9636672,-0.058523767,-0.6303067,0.10930626,-0.15126118,-0.69344693,-0.65802896,-0.5286006,-0.32760075,0.53548425,0.5116347,-0.28428915,-0.16660036,-0.30905616,-0.012965704,0.6731776,1,0.59100395,-0.9954418,0.190623,0.99902815,-0.5666473,-0.36538422,-0.9999791,-0.51235163,-0.8753122,-0.72465897,-0.21425919,-0.269999,0.6722624,0.36892164,-0.9003751,0.09800768,-0.1883687,-0.013748187,-0.46822634,-0.24443981,-0.08952933,-0.99993455,-1,-0.92851466,-0.124097265,0.021636784,-0.17280361,0.097309545,-0.46471202,0.94579273,0.586724,0.4880776,0.12093879,-0.17197075,-0.69332826,-0.0873636,0.32345587,0.01904129,-0.2433403,0.41831645,-0.89391357,-0.99976534,-0.061692115,-0.7800408,0.6917444,0.25112748,0.19357638,-0.9988017,-0.59103423,-0.34319726,-0.28006768,-0.43849564,0.29554492,0.021787517,-0.8277187,-0.19582736,-0.84622383,0.3208274,0.7199418,0.353354,-0.71359664,0.75997084,-0.38106096,-0.22186255,-0.21869938,-0.9991006,0.7653991,0.50363404,0.63615334,0.13437055,0.11831069,-0.08919088,-0.822223,0.13472907,0.11886927,-0.32090047,0.32974467,0.052070387,-0.48352584,0.48680782,0.3196339,0.121750526,0.99998134,0.92376,-0.024929365,0.44027326,0.5636143,-0.49404833,0.088691734,-0.91465145,0.020066299,0.3825795,-0.18283145,0.8601169,0.27615073],
    [53,1,"Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl",-0.38087294,-0.2577834,0.09537344,0.48111045,0.038257908,-0.4269939,-0.75185096,-0.05089843,-0.02865841,-0.41804507,-0.7219847,0.13196085,0.48155516,-0.41805246,-0.20917545,-0.46505553,-0.46390268,0.18843019,-0.13053565,-0.15512562,0.3734588,-0.6151806,0.144802,0.59567654,0.04423981,0.27116024,0.19040143,0.19336,0.29123446,-0.023825541,-0.2605823,0.4728058,-0.4488397,-0.4242254,-0.11584674,-0.31179002,0.29798794,0.68263227,0.952703,-0.9546076,-0.976782,0.08047233,-0.4558824,0.21057431,0.47637782,-0.9701282,0.012650966,-0.4051004,0.6145061,-0.36753565,0.5443211,0.026215032,-0.51021975,0.014844545,-0.79552215,-0.18119271,-0.6789164,0.77465177,0.34790456,0.5586731,-0.1811104,0.5389339,0.39248785,0.035950296,-0.34779567,0.7132961,0.17591895,0.5829762,-0.24752316,0.1463638,-0.547389,-0.1102491,-0.104558215,-0.7184316,0.87332195,-0.3148437,-0.14182736,0.010139514,-0.077421635,-0.9914186,-0.5046106,-0.33294457,-0.87578964,-0.1334037,0.45057243,-0.95520574,-0.48255923,0.2574104,-0.7453336,-0.23903705,0.001407753,0.66819906,0.17925562,0.50000614,0.8205345,-0.41827554,0.8562877,-0.25428084,0.07910399,-0.44362494,0.61361617,-0.46496308,0.4231894,0.8611424,-0.32152563,-0.32030854,0.15317246,0.25276563,-0.8950158,0.1262373,-0.5144472,-0.6177374,-0.024014607,-0.046515767,0.5544709,0.5843589,0.7944119,0.70364594,0.99794143,-0.45961565,-0.58372957,-0.2038505,-0.18141674,0.037504334,-0.67508906,-0.32561478,0.541008,-0.14602846,-0.608396,0.99996835,-0.25221267,-0.56987745,0.7359332,-0.16171813,0.0719028,-0.87258583,0.36768436,0.71647483,-0.47693038,-0.13581039,-0.99994016,0.23871794,0.99282724,-0.16966772,0.19990994,-0.3226712,-0.40704522,-0.24851793,0.883109,-0.42634124,0.13472584,-0.63429123,0.13962306,0.22291622,-0.3119219,-0.027478997,-0.16981678,0.9843887,-0.8276201,-0.15320717,-0.9626208,-0.7187631,-0.025795618,0.31247324,0.6443089,0.30229512,-0.13108556,-0.3068198,-0.21850841,0.088073045,-0.18334535,-0.28337675,-0.16160439,-0.26175314,0.44159114,-0.95624566,-0.8470227,0.45585033,-0.50841767,0.3488189,0.38281617,0.49714574,-0.20342757,0.44592282,-0.8162533,-0.23227564,0.15076977,0.32084212,-0.013041469,-0.38250542,0.37338424,0.04081986,-0.2974125,0.28204554,-0.40401617,-0.35295153,0.65841997,-0.29906058,0.5446265,0.83901775,-0.060446266,0.2856099,-0.75276005,0.2130956,0.6442182,-0.32246816,0.7360592,-0.5257031,0.48346072,-0.9990662,-0.061633013,0.51556605,-0.22029373,0.13337302,0.044404384,-0.21446036,-0.048202287,-0.30839095,-0.25726527,0.13070972,-0.17341608,-0.38092232,-0.4659755,-0.22517152,0.9678018,0.38404223,0.20439732,0.84208935,0.49165887,0.39921024,-0.42541635,0.05139884,-0.034777317,-0.5622006,0.44656524,-0.38984525,-0.16943584,-0.32789803,-0.3427901,-0.26259077,0.9347111,0.08450094,-0.4400537,-0.72238433,0.8737254,-0.19677286,0.7592283,0.29511863,0.10012546,-0.20968096,-0.18737645,-0.9787153,-0.45937836,0.78362983,0.001172097,-0.36602807,0.3095246,0.3726064,0.1271984,0.009165302,-0.10323624,0.3935858,0.37366807,-0.4372059,0.76053715,0.09050986,-0.43055883,-0.2323921,-0.71363825,0.40948755,0.2658396,0.64946777,0.04367601,0.3325574,0.41538775,0.88535905,0.17637992,-0.15829986,-0.098609336,0.12873557,0.45837095,0.99925035,-0.05765567,0.81313604,-0.56156325,-0.007434101,0.034179304,0.54863405,0.76568824,0.10451364,-0.35599014,0.9974369,0.08019155,0.21176986,-0.29214716,0.39625862,0.9999785,-0.99668163,0.5852671,0.6227668,0.49926975,-0.03230263,-0.67353445,0.36422193,0.05175886,-0.6833316,0.77333075,0.8180941,0.29465088,-0.09359013,0.21258546,-0.69518465,-0.21656533,-0.25441685,0.9199922,-0.74537283,0.33007455,-0.016400333,-0.93730456,0.37485614,0.16413088,0.10789627,0.5670801,-0.8851258,-0.28732803,0.06820287,0.33178282,-0.97298765,0.2658662,0.30565777,0.10406366,-0.57042277,-0.13638887,0.10569254,0.3310496,0.91197795,0.11319806,0.4043796,0.040816076,0.49771374,-0.007309539,-0.6025717,-0.4648218,0.3011186,0.33211663,-0.039621457,-0.36294886,-0.07376764,-0.49088582,0.43052608,-0.9943939,0.25250873,-0.22576396,-0.71169645,-0.22648135,0.71452767,0.026068486,0.99970335,0.40842727,-0.16753072,-0.16300039,-0.011138317,0.7399711,0.31833777,-0.9497741,-0.535316,0.54055285,-0.47540694,0.24683139,0.14945476,-0.38360244,0.4045905,0.5541385,0.7685713,-0.22356278,0.9985716,-0.009829895,-0.6357794,-0.11734854,-0.001637349,-0.59485954,-0.33152652,-0.287598,-0.28188396,-0.63805985,-0.63513917,0.06569002,0.08751715,-0.3140823,0.70208204,-0.1882204,0.5576859,-0.68247706,0.3359474,0.6101686,0.072413735,-0.49846488,-0.10649072,-0.004812188,-0.6181224,-0.8868289,0.1224065,-0.27161267,0.3412168,0.24036935,-0.08074221,-0.25027958,-0.4724788,-0.14409234,0.3438816,0.2616296,0.7041427,0.34551018,0.32191586,0.78004986,0.043417316,0.99990743,-0.06474881,-0.98999816,0.28303444,0.9994272,-0.50326234,-0.1847727,-0.99775475,-0.030181017,0.20500639,0.40195224,-0.16815929,-0.37791327,-0.18641748,-0.0326674,-0.7166199,-0.07884434,0.25233504,-0.52849466,-0.30701506,0.4695507,0.07142628,-0.9999769,0.9902036,-0.94605464,0.12668782,0.18391594,-0.21347727,-0.21510452,-0.8026711,-0.6234078,0.3922456,-0.4920041,0.077130534,-0.92200875,-0.07518383,-0.19451275,0.21040455,0.16624226,0.14977051,0.02109932,-0.80614054,-0.9998945,-0.11390942,0.25904083,0.20511708,0.31027249,0.053386725,-0.9955124,0.34377077,-0.4189306,-0.30432463,0.29982823,-0.4708859,-0.41173708,0.9826523,0.008962944,0.6203106,0.23413193,0.51491857,-0.21066792,-0.69624406,-0.5432059,-0.1179122,-0.13051233,-0.72348523,0.7957455,0.136469,-0.20396839,0.3680178,0.1884444,-0.42574316,-0.17427036,0.7142855,-0.6873954,0.32429063,-0.1548968,0.64264286,-0.06087727,0.1490887,-0.19174597,0.16846369,0.344525,0.9996281,0.87904453,0.03325124,0.12567969,0.21558915,0.2658821,-0.25179365,-0.77758527,0.15722932,0.736858,0.47782156,0.22484662,-0.24098942],
    [54,1,"CCCN(CCOc1c(Cl)cc(Cl)cc1Cl)C(=O)n1ccnc1",0.12725127,-0.21509865,-0.17184137,0.19986457,0.45106217,-0.72465014,-0.1678151,0.37893495,-0.29578695,-0.30528802,-0.7488802,-0.83951086,0.24331929,-0.58536774,0.35050395,-0.7029581,0.295959,0.30057707,0.33119434,0.57065445,0.1290919,-0.26580083,0.12395102,-0.20318241,-0.2852755,0.16944347,-0.2903164,-0.14019802,0.5459063,-0.5097926,0.54441893,0.31563473,-0.11867787,-0.28758666,-0.6154495,-0.6015621,0.743496,-0.5125525,0.9972439,-0.7527074,-0.79735607,-0.25570056,-0.22377554,0.6236023,0.12478968,-0.18254934,-0.52318406,0.46300814,0.82680744,0.2954498,0.14703152,0.034552157,0.6015768,0.023518892,0.04642816,0.10769523,0.106398195,-0.05311938,0.17404222,0.07454133,0.5461009,0.47906637,-0.44436625,0.45018154,-0.34770182,0.85935265,-0.5179821,-0.00862006,0.048605625,0.052662477,-0.8992386,-0.6953023,0.13169865,-0.49523926,0.14059983,-0.51893884,-0.08825939,-0.34650058,-0.75984293,-0.9995322,-0.19090869,0.4567099,-0.88473284,-0.74721706,-0.4281086,-0.90520823,0.06318091,0.47767895,-0.5571488,-0.07136084,0.17319113,0.23037244,-0.106170446,0.67244685,0.9984742,-0.4178995,-0.021361776,0.405922,0.43982401,-0.11897938,0.26284647,-0.2674469,0.4979929,0.96799785,-0.9857173,-0.7583634,0.41653946,0.07286557,0.9830938,0.7556161,0.7992979,0.2640862,-0.026057132,0.06598591,-0.22832586,0.49526522,0.54747707,0.8165888,0.98362696,0.26301357,-0.18621027,0.7796296,0.081229664,0.19530217,-0.7404511,-0.32044592,0.066087514,-0.006989998,0.14268917,0.9998389,-0.37740856,-0.090823874,0.26734447,-0.023044972,0.775777,-0.9941093,0.09993691,0.13363896,-0.11243634,-0.7648395,-0.99983555,-0.433945,0.8836314,-0.6411598,-0.6790603,0.17819335,0.41474164,-0.1457545,-0.8387574,-0.5390237,0.5922655,-0.68261206,0.08394896,-0.5452462,-0.25118655,-0.016792396,0.2447191,0.38502514,-0.75351954,-0.94351715,-0.68099385,-0.31433752,-0.7295121,0.7986231,0.85625213,0.39416057,-0.003790338,-0.5867023,-0.3802886,0.039190285,0.6097492,0.17433758,-0.74733037,0.15909874,-0.26150692,-0.6447503,-0.57150185,0.83066016,-0.43325734,-0.04653802,0.68027943,-0.6640042,-0.26804632,-0.065373376,0.15386796,0.6830772,0.2088068,0.3821086,-0.3657781,-0.40833494,-0.83298534,0.18074784,-0.31064662,-0.0196877,-0.25980413,-0.47350913,0.73621595,-0.71680456,-0.124611475,0.58095145,-0.58500427,-0.5216838,0.18952464,-0.20376912,-0.07059776,-0.12336831,0.15779552,-0.42177302,0.5103261,-0.9997598,0.45134053,0.29529926,-0.10110545,0.015623415,-0.15505245,-0.03498508,-0.41981962,-0.18770896,-0.1551491,-0.17665802,-0.2444161,0.22567622,0.1680622,-0.036959648,-0.9839924,-0.30650285,0.7121461,0.28003457,-0.36932778,-0.019810624,0.004869128,0.60506403,-0.31971404,0.4934217,0.2859449,-0.3003017,0.52240545,-0.7444347,-0.16447814,-0.27044624,0.7855694,0.27879596,0.6595811,-0.77324736,0.28495926,-0.10737186,0.5064764,-0.52295303,-0.115566134,-0.39598855,0.68998677,-0.9650928,0.24920128,-0.029506791,-0.23517695,-0.26861256,0.42887995,0.5347214,-0.14548369,-0.32766238,0.33480945,0.38070756,-0.6896104,0.39729947,0.5649699,-0.43905947,-0.65583384,-0.06248028,0.8162006,-0.21344349,0.5879072,0.9936379,-0.018419094,-0.28247765,-0.0558645,-0.14209448,0.2342841,-0.6169695,-0.7718257,0.36125875,0.7099732,0.9964741,-0.46157518,0.10156746,-0.50517577,0.3858187,0.44108483,0.92269146,0.94858205,0.23902695,-0.44785345,0.9376331,-0.4846175,-0.24466394,-0.17583877,-0.7275191,0.9999561,-0.9888631,0.16135818,0.8322201,0.15204749,0.20957586,-0.14783221,-0.16923067,0.33209473,-0.21283893,-0.9406425,0.26295033,0.7854786,-0.76549387,0.7257155,0.09422194,-0.26518926,-0.33453748,0.4875378,0.14936464,0.097097605,-0.92325807,-0.9999584,-0.23698504,-0.39166984,0.17724983,-0.23814143,-0.39533952,0.18641111,-0.58933055,-0.051537305,-0.91071385,0.8159168,0.63009244,-0.6449472,-0.15818857,-0.53506106,0.25348303,-0.15052576,0.67572445,0.32805774,0.47851145,-0.3539832,0.21280226,-0.27236065,-0.07765347,-0.064505376,0.075187914,-0.55431706,0.028932039,-0.64451474,0.6050105,-0.46906298,-0.7215929,-0.9539321,-0.19963951,0.003150776,0.00109291,-0.29771477,0.58434504,0.39663452,0.9995816,-0.30554733,-0.16301621,-0.88382083,-0.13174662,0.4012444,0.21617413,-0.69300824,-0.40640092,0.7729354,-0.3327651,0.2578537,0.667101,-0.559672,0.7459683,-0.6463816,-0.52590203,0.23621513,0.987861,0.42732817,-0.059760783,-0.1425782,-0.24629162,0.1390043,0.5378058,0.30110368,-0.6911151,0.12148579,0.008422692,-0.056426674,0.18696176,-0.5618934,0.3277545,-0.5418878,-0.27294555,0.40240985,-0.43372247,0.03757451,-0.67930835,-0.22162694,-0.58581364,-0.8176403,-0.5102734,0.32975146,-0.57199514,-0.4535731,0.31564173,-0.662198,0.19840261,-0.59604794,-0.3411039,0.20058505,0.03695497,0.42681298,-0.010645646,0.56399006,0.27004445,0.23259282,0.53531957,1,-0.11273262,-0.94460386,-0.012098243,0.99875027,-0.47683808,-0.7060587,-0.9999394,0.027521254,-0.9253484,-0.5166226,-0.22068796,0.21238478,0.16567937,-0.30389073,-0.39187437,0.66338444,0.6136815,-0.60366815,-0.5697796,0.4832416,0.5498383,-0.999976,0.9965154,-0.3881051,-0.15251094,0.24280904,-0.15112719,0.46676305,-0.18573034,0.18272386,-0.6214831,-0.41131678,0.80803525,-0.4428522,-0.049218733,-0.6058358,-0.07659587,-0.82587916,-0.21467121,-0.17246957,0.61741334,-0.9996145,0.13208474,-0.20497915,0.17881432,0.26875564,0.38182542,-0.9380699,-0.13087763,0.3126347,-0.49629873,0.050152592,-0.472445,0.5327237,0.95941985,-0.1655414,0.4701908,-0.55106014,0.48199517,-0.6320823,0.14297174,-0.64199513,-0.31697673,-0.5062241,-0.5649666,-0.8122199,0.75667256,-0.67646265,-0.1363296,-0.21236926,0.06865807,0.4300615,0.23253372,-0.42828125,-0.16506429,-0.055691376,0.995637,-0.32518205,-0.25563204,-0.35023916,0.097571224,-0.2590786,0.99994206,0.8513332,-0.14961594,-0.008637579,0.35709757,0.28488493,0.34466043,-0.99539137,-0.5884793,0.63991463,0.49783033,-0.037581205,-0.26652846],
    [55,0,"CC(C)=CCCC(C)=CC=O",-0.16998848,-0.48455098,-0.13783963,-0.4862713,0.08658146,-0.036023464,0.39225957,0.5534838,-0.41172972,0.29661873,-0.5723308,-0.002369236,-0.10757044,-0.5576642,0.32742435,-0.25997645,0.62672013,-0.38888443,0.683914,-0.106594734,0.50827175,-0.890784,-0.40365538,-0.32938293,-0.032781806,0.38236234,0.12533844,0.40767372,0.20655043,-0.35171965,-0.2256337,0.6490759,0.6174688,0.3144204,0.14956981,0.5110267,-0.10473949,0.72603506,0.030980667,-0.76904863,-0.96412045,-0.6158108,-0.12626442,-0.17175424,0.18819803,-0.99305224,0.22772668,-0.37911913,0.99954957,-0.6618622,0.20078985,0.5673855,0.6613255,0.31019732,-0.9453999,0.06926251,0.6733339,0.9676348,0.258378,0.13289025,0.1175644,-0.6507285,-0.16304651,0.60418266,-0.5925859,-0.29020143,0.47471222,-0.07205894,-0.32281846,0.42998976,0.92030686,-0.94732267,0.032129675,0.7578525,0.5399678,0.46244618,-0.27234873,-0.36015326,0.12684327,-0.9999646,-0.055161763,-0.25400186,-0.23876289,-0.55036,0.7054477,0.09362308,0.26963156,0.04602504,-0.5194046,0.1634271,0.5049733,0.104314,0.46874243,0.19024059,0.9171449,0.022325534,0.24634033,-0.24313779,0.6678814,0.091940135,0.44590327,-0.47076628,0.4603624,-0.29395577,0.88427347,0.48917437,-0.24929363,0.6998895,0.9803256,-0.29147327,-0.15341313,0.35152864,0.6321595,0.3090634,0.20984145,0.7324235,0.648861,0.15340933,0.99792486,-0.15586965,-0.28357014,0.11198543,0.46648264,-0.50857586,-0.24299854,-0.3949732,-0.37734282,-0.27366054,-0.22853027,0.9997137,-0.17495508,-0.44374064,-0.21186748,0.18089642,-0.6893126,-0.977176,0.7290757,-0.48355582,-0.5671159,-0.3159631,0.9981674,0.5927533,0.9922085,0.23757519,-0.37619433,0.45043314,-0.2508524,0.14429368,0.97199184,0.05113063,0.14245743,-0.88712305,0.50030786,0.23655388,0.35972443,-0.37301403,0.153005,0.99827224,-0.6432727,-0.9655689,-0.988732,-0.18103445,0.087192655,0.38747713,-0.11998223,-0.441296,0.7036148,-0.3542573,-0.13249691,-0.37879354,-0.27790424,-0.30667984,-0.13868503,-0.57962954,0.047596164,-0.9675659,-0.4777678,0.11347323,-0.36080003,-0.21064079,-0.71289086,-0.22272721,0.4455638,0.13129385,-0.89468503,-0.10968623,-0.33656338,-0.2081304,-0.40412542,0.07776434,-0.2740223,0.44984996,-0.5129134,0.19421999,0.3618391,-0.61166143,-0.39928174,-0.6368763,-0.41668394,-0.5122036,0.082881,-0.33323106,0.20428321,0.46632254,0.023836955,0.24142201,-0.38698348,-0.14599364,0.061603986,-0.9748842,0.39889732,0.011512419,0.5057297,0.31598878,-0.3126203,-0.5935874,0.45954525,0.6989367,0.23236957,0.13472533,-0.18203625,0.23218633,-0.33353272,-0.8837829,-0.9502446,0.28309682,0.4589072,-0.64819777,-0.62678057,-0.017516058,-0.5086592,-0.15881945,-0.23964828,-0.10569626,0.46244296,-0.114571355,-0.17060867,0.22031084,0.041098554,0.038296264,0.80377674,0.44796765,-0.059797894,-0.81291705,-0.7834286,0.039424066,-0.19639893,-0.124288805,0.54518884,-0.3129236,0.18812187,-0.99979377,0.279446,0.28088078,-0.15446705,0.28817135,0.34668952,-0.5966676,0.014428434,-0.2995025,-0.5196096,0.47839573,-0.5750898,-0.69683504,0.55112404,0.16263461,0.25623608,0.43248868,0.9403753,0.56965226,-0.22842573,0.8707155,-0.22045547,0.24539271,-0.3272535,-0.21920507,0.008407111,-0.7464606,0.59132296,-0.11821083,0.23480196,0.9995252,-0.7855692,0.34264234,0.5826771,0.5862143,-0.3817744,0.7619037,0.9213774,-0.32174197,-0.4768754,0.9991786,-0.3773242,0.659798,-0.09808314,-0.16193739,-0.9920242,-0.9856618,0.7210498,0.19291413,-0.25743282,-0.5283138,-0.61763346,-0.4915611,-0.03827049,-0.9429243,0.99544835,0.24341182,-0.17880422,-0.4212161,0.6442771,-0.14835869,-0.11323972,-0.3857155,0.86387485,-0.06279624,0.55023235,0.5023953,-0.99997014,-0.27986693,0.26121068,0.45639408,0.11143497,-0.08682348,0.062826484,-0.14621323,0.399007,-0.9247932,-0.3933452,0.64016336,-0.07720496,0.003664193,0.29181558,-0.23337296,0.21757855,0.7310192,-0.21074457,0.37525776,-0.19245513,-0.54384416,0.6474646,-0.072526276,0.37662652,0.25669184,0.21714488,-0.28081954,-0.32467946,-0.0702352,0.37742016,0.96142614,-0.9957931,-0.014550143,-0.5754127,-0.5695408,-0.10446536,0.1086201,0.02924829,0.9986927,0.27156615,-0.110429,0.38233113,-0.117835246,-0.83080727,0.30247244,-0.6791421,0.52149355,-0.27355635,0.32840118,-0.27050015,0.22934958,0.117750816,0.43029913,-0.13590683,0.92441046,-0.23926647,1,-0.30845046,0.18838535,-0.11260145,-0.6407288,-0.9344367,-0.0179176,0.52782375,-0.23973815,0.43508938,-0.46567494,0.35912618,-0.0836093,0.17197804,0.19922408,-0.30756408,-0.2757812,-0.6551096,-0.2177079,0.13611048,-0.9104969,-0.005437759,0.1997422,0.034029108,-0.004408604,-0.927651,0.28174827,-0.44502336,-0.1354687,-0.4158535,-0.3013635,-0.7088449,-0.44490254,-0.6067724,-0.64809203,0.7524872,-0.08910638,-0.26394022,0.13242863,-0.48160973,-0.5309554,0.9999999,0.37718877,-0.6957457,-0.49626195,0.999701,0.015643815,0.3976009,-0.9999516,0.7280934,0.14807959,-0.61464053,-0.01562912,-0.6294023,-0.28300968,0.5715014,-0.4176137,-0.08942489,0.062435754,-0.5416769,-0.18608552,0.23734155,0.6070258,-0.9999099,-1,-0.9919485,-0.6607694,0.26023078,0.39026684,-0.017058557,-0.109620176,0.528808,-0.17443456,0.2453699,-0.35531956,-0.5755476,0.097990446,-0.12279933,0.15002899,-0.031875107,0.5394256,0.23653224,-0.98063743,-0.9998005,-0.23769307,-0.08596025,0.27879804,0.19110623,0.14095418,-0.9826852,-0.013073942,-0.20182237,-0.012800354,0.65283036,0.64846426,0.25051808,-0.8340717,-0.009175496,0.39332366,0.5417257,0.46769294,0.3326601,-0.10671205,0.7540552,-0.06792885,0.3457082,0.049130615,-0.92952746,0.57515657,-0.30394772,0.6439327,-0.46408242,-0.3237929,0.102588676,-0.25565454,0.71893615,-0.6861705,-0.0240532,-0.8643122,0.0638703,0.68264073,0.42811576,-0.24777718,-0.17102075,0.9996871,-0.18903576,-0.4422447,0.79962754,-0.08281455,0.23280784,-0.07799025,-0.121778615,0.545727,0.102455504,-0.02243488,0.49347457,0.18337002],
    [56,1,"CCCCOC(=O)c1ccc(O)cc1",0.5449551,0.14500453,0.19736044,0.20739307,0.4656322,-0.0836286,-0.52009296,-0.018937647,-0.039374374,0.13164292,-0.4841152,-0.39861834,-0.22392307,-0.72004974,-0.018902984,0.5818688,0.48195896,-0.05440981,0.13681212,-0.065459274,0.32747284,-0.77664155,0.4424402,0.42722687,-0.24170525,0.28409111,0.19472979,-0.18244594,0.36355272,0.057426095,0.060976878,-0.07124023,0.2800914,-0.13631088,0.4098138,-0.30323344,0.20229213,0.3577796,0.61901987,-0.8849611,-0.9966173,-0.04005343,0.19908175,-0.027910884,-0.037673447,-0.98925024,-0.058847312,-0.27349013,0.9876807,-0.010489179,0.6994735,-0.08554709,-0.30095458,0.39401874,-0.80411875,0.13066444,0.48426348,0.94211525,0.576982,0.123493455,0.00029505,-0.4340671,0.4122486,-0.34711522,0.17756888,0.73168755,-0.061662864,0.3220132,0.27885592,-0.4014265,0.51811135,-0.9907286,-0.019831745,0.3177999,0.6806211,0.6651301,-0.5005121,0.049722925,-0.37823132,-0.9994978,-0.6757346,0.20356786,-0.87649393,-0.27628383,0.2823034,-0.02246821,0.20877813,-0.03389437,-0.19505844,-0.51350635,-0.29913864,-0.15966427,-0.17438816,0.112554885,0.98648584,-0.2775423,0.03213542,0.041777488,-0.26385975,0.09043266,-0.089992866,-0.018360198,0.15120237,0.53909874,0.7090382,-0.6006594,0.43620536,0.27037087,-0.91186875,0.50374186,0.48102212,-0.59912413,-0.28339592,-0.096092425,-0.02127082,0.31172305,-0.21436714,0.51262283,0.9987871,-0.042410914,-0.07296124,-0.11992914,0.16896443,0.11656874,-0.68553054,0.14564581,0.2441005,-0.7164425,-0.15989469,0.9987671,0.34446704,-0.2393779,-0.3339105,0.003304816,-0.53594184,-0.59536994,0.2286209,0.22425213,-0.5186714,-0.43583992,-0.9976048,0.29249662,0.9647682,0.33735406,0.030830821,0.011292242,0.50709426,-0.589094,0.9744974,0.43966788,-0.19452293,-0.6654599,0.3282497,-0.001487404,-0.38240087,0.37901774,0.36355272,0.9976207,-0.49724343,-0.7344978,-0.9902224,-0.028947726,0.03086793,0.33899054,-0.14151028,0.11533128,-0.11047788,0.24801818,0.054922663,-0.23077412,0.024256254,0.022185856,0.46319583,-0.45162573,0.25061965,-0.96581197,-0.6192007,0.27227554,-0.60410005,-0.462804,0.7171857,-0.85518676,0.44483337,0.29145756,-0.87061197,-0.09375623,0.5746983,0.31627065,-0.31078073,-0.18148625,0.004295833,-0.34745097,0.264587,0.086558565,0.3671954,-0.19347851,0.18501706,-0.64374554,0.23974544,0.3075001,-0.53475356,-0.56041634,0.10914731,0.40710193,0.17645697,-0.3305729,0.3740465,-0.31554618,-0.22986437,-0.9863818,-0.553355,-0.10452382,0.36600938,-0.5307222,0.18055756,0.28532568,-0.08638127,-0.046793174,-0.10104577,-0.052658383,-0.026628228,-0.033072352,-0.010647318,-0.40426886,0.9993043,0.12903848,0.26599193,0.08086339,-0.39645782,-0.061678883,-0.23705555,-0.30541873,0.6712887,-0.1645463,0.20730269,0.1227247,-0.30153468,-0.009458065,0.52165395,0.40926522,0.9290264,0.15233631,0.25772417,-0.6593981,0.39338127,-0.16177887,0.22085391,0.43982962,-0.5026748,-0.2103676,0.09305557,-0.99772537,-0.06679771,0.63131016,0.13339283,-0.3929037,-0.25800937,0.1365152,0.5051173,0.20492986,-0.2862849,0.4942943,-0.016726255,-0.48546913,0.24970908,0.30969745,0.431722,0.16470852,-0.4716718,-0.10748497,-0.13706912,-0.45241162,0.17766692,-0.4671893,-0.21619919,-0.2747189,0.29907182,0.29379073,-0.38762558,0.7044736,-0.4309006,0.99952596,-0.27132207,0.25968534,-0.33169585,0.1107876,0.18538879,-0.5067009,0.43295804,0.11850298,0.4997217,0.9992838,-0.59275293,0.6241101,-0.2513921,0.34782207,0.99811494,-0.8921391,0.11530295,0.2937034,-0.47055593,0.40490144,-0.2682727,0.22430341,-0.37361455,-0.62942773,0.97692305,0.13110784,0.3366272,0.23923296,0.015959555,0.25526354,0.008893567,-0.46418133,0.3975628,-0.22031277,-0.47345787,-0.20851177,-0.97327524,-0.7006368,-0.30639654,0.1675129,0.2863107,-0.86177504,0.003742128,-0.23394313,-0.051021244,-0.9144001,0.48734653,0.06731147,0.07260127,-0.019809349,-0.006538723,0.16270494,-0.18695693,-0.43122542,0.37412348,0.058655035,0.4534656,-0.44852436,0.003731458,0.27877617,-0.017393319,0.83641696,0.15155703,-0.22939458,-0.14261152,0.049129616,-0.2785061,0.87392837,-0.99537134,0.37687424,-0.124559164,-0.2808359,0.05280436,-0.10329223,0.6200901,0.99902767,0.42310083,0.2851461,0.069520004,0.60218465,0.40522042,-0.19131054,-0.6319765,0.28801525,-0.4297374,-0.51831686,0.45538744,0.42794743,-0.093812436,-0.033207692,-0.44928458,0.9016446,0.57630324,1,0.08973232,0.47871754,-0.13180839,-0.32594353,-0.74044573,-0.50440323,0.21314798,-0.46885633,0.4654263,-0.47464046,0.5218874,0.47941667,0.37960926,0.54892623,0.020575918,0.10067273,0.028656853,-0.5430873,-0.058652814,-0.48484266,0.0951529,-0.13007881,-0.056452177,0.4301176,-0.51368946,0.4718163,-0.14803426,0.3189102,-0.27455243,-0.32051665,-0.38655245,-0.087554656,0.039308056,-0.15925273,-0.25210452,0.1315879,-0.3452709,-0.15647753,0.5668302,-0.20237334,0.9999601,-0.49900296,-0.96893734,-0.22543576,0.99953794,-0.45595852,-0.3351267,-0.99788517,-0.14492816,-0.30149022,0.3332567,-0.22765131,-0.07252258,0.5319293,0.27460033,0.32597405,0.48294994,0.5500816,-0.23712173,0.36238682,-0.17555448,0.032294523,-0.99993896,-0.9989176,-0.9784194,0.36067694,0.07235793,0.17222261,-0.12966232,-0.3955615,-0.32311144,-0.36996412,-0.15999378,0.19412816,-0.82345134,-0.25345245,-0.15688583,-0.52440286,0.5013089,-0.12300952,-0.34615788,-0.9676544,-0.9998993,-0.4205536,-0.6525006,-0.008576963,0.5771116,0.066760935,-0.9364656,0.3755343,-0.34328207,0.08621373,-0.5482668,0.003506847,0.020425828,0.94082385,0.13642001,0.657467,0.29774362,0.53707856,-0.24662316,-0.5823844,-0.3968164,-0.1549289,-0.33144376,0.44700828,-0.053673618,-0.056703363,-0.40283185,-0.4444056,0.002381316,-0.58167404,0.26345876,0.18668756,-0.68078905,0.22201276,0.2243394,-0.38972715,-0.04363302,-0.53516537,0.10695162,0.12818919,0.2500216,0.99996215,0.24373068,0.2217085,-0.30748913,0.5588412,-0.004142663,-0.18756045,-0.28544068,-0.3446951,0.07565727,-0.47903943,0.34966362,-0.25082988],
    [57,1,"COC=C(C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1",0.52697444,0.33374393,0.101118624,-0.5062257,-0.039402958,-0.31869534,-0.40438414,-0.26641265,-0.26127085,-0.66783696,0.52911276,-0.074675255,0.12911855,-0.34691578,-0.34899718,0.35565773,0.34539226,-0.17965065,0.51525944,0.46704432,0.7978825,0.33066761,-0.18807313,-0.49457172,-0.09942032,0.23732157,0.28774443,0.7888,-0.7279037,0.6543823,-0.21073197,-0.57969683,-0.047379013,-0.39801475,0.48536143,-0.68195915,0.3115975,0.8228544,0.9997462,-0.40142807,0.19314735,0.046003327,0.006142356,-0.7499928,-0.20554554,0.83703464,-0.095076054,0.29741827,0.9058918,0.4816328,0.6517056,0.5156486,-0.7936422,0.47262022,-0.04142101,0.3091654,-0.5131543,-0.89403546,0.2809433,-0.4989877,0.07069537,0.33462372,0.19993497,-0.55384564,-0.84238124,0.32151315,-0.57110476,-0.081086405,-0.5565411,0.21505336,-0.6723586,-0.92235756,0.12587409,-0.7680201,-0.37166783,0.17933193,-0.5992003,-0.81564015,-0.23926331,-0.9994944,0.8769428,-0.4304076,-0.9618759,-0.06780816,-0.13465932,-0.8509131,-0.30605596,-0.012723201,-0.6777883,-0.3693537,0.24294928,0.13171025,-0.000276629,0.67870146,0.99987596,-0.007066176,0.28287405,-0.71673375,0.10748834,0.63794047,0.3739668,-0.7386526,-0.5448174,0.94548124,-0.9997171,-0.99008936,0.16538505,0.027231295,0.9642622,0.3887769,-0.32935897,-0.56943893,-0.38081855,0.73693883,0.2966586,0.5588975,-0.4534987,0.3965845,0.8499608,0.15928833,0.18848331,0.2406588,-0.09053619,0.3602649,-0.41761622,-0.4099043,-0.5682984,-0.4270296,0.49760443,0.99729365,-0.21350324,-0.000208873,-0.15013482,-0.04756327,-0.28909737,-0.9930968,-0.28826877,-0.14981504,-0.52784127,-0.55309206,-0.99999785,0.056636255,-0.49848318,-0.5404325,0.13983454,0.43463868,-0.13986675,0.25076005,-0.9986491,-0.121291675,0.79291636,-0.74920344,-0.35112676,-0.55709565,-0.5443821,-0.12318903,0.19480444,-0.9518365,-0.74470484,-0.95525324,-0.057773296,-0.69967836,-0.18608972,-0.123658955,-0.16753344,-0.27951357,-0.76358044,0.06753655,0.11541862,0.3817359,0.5926494,0.4706693,-0.3950071,0.28487822,0.7248695,-0.15994424,-0.64289206,-0.5123647,-0.7329441,-0.027825972,0.52458435,-0.9975901,-0.6963544,0.17918728,0.87120396,0.44140425,0.0840611,-0.20938465,-0.018889787,-0.45582622,0.64564115,-0.18069543,-0.4649442,-0.22068948,0.3713695,0.07552842,-0.2294882,-0.65237916,-0.512093,0.21595985,0.5854217,-0.24464294,0.019761186,0.18200174,0.3801911,-0.46871412,0.28021625,-0.6900628,0.81877196,-0.999967,-0.39001137,-0.61533666,-0.18437773,0.5083326,0.2777993,0.54075944,-0.4367563,-0.12230959,-0.15248436,0.28242475,0.010221786,0.21188536,0.4802576,0.067029044,-0.9913143,-0.067814454,0.7480648,-0.34556592,-0.5611142,0.6488642,0.119366,0.73912716,-0.35607305,-0.2140966,-0.35162583,-0.13261245,0.14143668,-0.6064221,0.587352,-0.04820188,0.9392579,0.05664123,-0.71880144,0.23346055,0.74510103,0.2018628,0.54172105,0.5460959,0.45702767,-0.16171817,-0.053993225,-0.7458985,-0.44563293,0.7450121,-0.5310277,-0.28514352,-0.6154394,0.6283234,0.00392467,0.23265067,-0.23806068,-0.72731835,-0.25501257,0.13385662,0.30694097,0.84874946,-0.59883785,0.46504194,0.88760287,-0.42978153,0.6240754,0.9997867,-0.040479854,-0.14119513,0.62086886,-0.63420963,0.4760884,-0.3208727,-0.04793689,0.7576164,-0.18519688,0.9448536,-0.8040143,0.23913214,-0.7299439,0.3803515,0.56769663,0.72497785,0.020331508,-0.09538001,0.13795316,-0.19652595,0.601703,0.4695961,-0.371723,-0.21775825,0.99999905,-0.8972463,0.28998724,0.38588423,0.4120054,0.65450925,-0.7671889,0.2273215,0.70044583,0.26994532,-0.9985282,0.34054443,0.60601705,0.27917457,-0.6979298,-0.32059184,-0.40853724,0.1336782,-0.659266,-0.110959224,-0.24865533,0.3394801,-0.9996039,0.4380741,0.31246307,0.033591997,-0.3260627,-0.8366506,0.6894344,0.7722368,0.57815355,0.09064529,-0.375437,-0.33270475,0.17122328,-0.14959882,-0.14581472,0.4418872,-0.011381649,0.047804404,0.84395546,0.4183369,0.3004923,0.26559842,0.7285074,0.21133673,-0.1978515,0.6390406,0.7141866,-0.053578425,0.10014173,0.3004434,0.3195366,-0.96983534,-0.3405661,0.632779,0.27851033,-0.035008986,0.17734839,-0.016933247,-0.47985205,0.9994125,0.6342394,0.41828075,0.34556615,-0.50870097,0.34030813,-0.62279046,-0.6409111,-0.3815174,0.03095568,-0.113847375,0.08106365,-0.47440383,-0.03652184,-0.71428543,0.5526415,-0.860568,-0.52699876,-0.9892174,0.19426998,0.7000042,0.5434657,0.68950015,0.42294574,-0.2851725,-0.6617463,0.20846136,0.3782904,-0.15094556,-0.0661853,-0.44054675,-0.4801737,0.7020283,0.8119847,-0.39548275,-0.44354135,-0.22218382,0.6701424,-0.57653767,-0.3093205,0.29962307,-0.21111275,0.6101122,0.9915924,0.08233156,0.27849856,-0.5490758,0.20223895,-0.7148148,-0.36530754,0.6658711,0.771847,0.17712532,-0.7072412,0.1347061,-0.08904131,-0.23006207,0.6162138,-0.46171388,0.99999803,-0.5348517,-0.9248423,-0.07556437,0.994736,-0.15400028,0.66866034,-0.99985415,0.4748927,-0.8767568,0.52613086,-0.13105348,0.49804923,-0.53416175,0.37206617,0.420538,-0.67161196,0.39473867,-0.24943978,-0.45504305,0.5527921,-0.05196788,-0.9995775,0.99999976,0.6054077,0.09792561,0.31571537,-0.1909908,0.45417565,0.018860003,-0.070568025,-0.65615755,-0.32377827,0.7213658,-0.7016723,-0.009878567,-0.19930957,-0.4638286,0.33825767,-0.21738954,-0.80572295,0.95647466,-0.9980379,0.43350208,0.33194676,-0.14041631,-0.13396274,0.29039836,0.7120999,0.72741014,0.42746764,-0.020827074,-0.6849816,-0.1315304,0.20038897,0.99154484,-0.19731578,0.23601188,0.24833775,0.13231209,-0.2669459,0.47592145,-0.17958045,-0.5068447,0.37413168,0.6948792,-0.98745453,-0.68202233,0.02473338,0.23674051,-0.13252859,-0.120047875,-0.46350303,0.7106698,-0.025456266,0.6411218,0.30294505,0.9995673,0.28632548,0.5599439,0.14288098,-0.001265195,-0.6061228,0.99993026,0.75112313,0.26072448,0.4667179,-0.35537148,-0.67173,-0.31454486,-0.9992742,0.032210425,-0.5158366,-0.36101368,-0.62640595,0.28417516],
    [58,1,"O=[N+]([O-])c1ccccc1[N+](=O)[O-]",-0.11395757,-0.17277507,-0.3848051,0.16542986,-0.41722965,-0.50663453,-0.56927365,0.12296794,0.6009861,0.30883893,0.42846388,0.41066942,-0.03954246,0.29521963,-0.47283912,0.2800449,0.016464774,0.6530594,-0.17644662,0.6766805,0.84661263,-0.704272,0.17617172,0.27401084,-0.028122718,0.23464027,0.64312005,0.19438863,-0.39851338,-0.6840289,0.24691267,0.26960042,-0.4887051,0.090317436,0.6084449,-0.20825224,0.4697097,0.7239442,0.51710606,-0.5521128,-0.9979632,-0.15161914,0.13032728,-0.19526316,-0.43303683,-0.9973885,0.5168408,0.015686978,0.99361265,0.021331877,-0.14649653,0.070476584,-0.47111186,-0.022052957,-0.8861979,0.2606082,-0.75086373,0.90063256,-0.15572377,0.75706387,-0.17680535,0.30286843,-0.4514285,-0.3856271,-0.061411414,0.62552845,0.71876764,0.1985798,-0.22161472,0.15084554,0.8517967,-0.99820626,0.46924627,0.26949632,-0.7818178,0.4392195,-0.42954317,-0.12431403,0.27936816,-0.9992072,0.6850871,-0.6214494,-0.8510764,-0.8367888,0.15546739,0.7894042,-0.025269117,0.0959749,-0.93477976,0.23273723,-0.2535325,0.2840239,-0.39269766,0.02841652,0.99688554,-0.3421626,-0.4168599,-0.53125185,0.52432287,-0.23528183,0.7944625,-0.6767762,-0.013092994,-0.6201278,0.8243269,-0.835746,0.0375013,0.30674756,0.99847835,0.10864242,-0.17461583,-0.14337377,-0.4952804,0.23356003,0.21619447,-0.114566945,0.56268984,-0.006472478,0.99980545,-0.5317884,0.32326654,-0.15025136,-0.5255415,-0.18896534,-0.442377,-0.46362245,-0.3541652,-0.06029128,0.34579024,0.9811261,0.18579724,0.47871917,-0.17168538,0.0058896,-0.18596278,-0.9268819,0.49399197,-0.17011507,-0.65886,-0.41473803,-0.97539365,-0.40819898,0.6354472,0.06558104,0.36833954,0.1323335,0.23321696,-0.069202155,0.9921003,-0.005417267,-0.3134513,-0.43976787,-0.70887256,-0.004050978,-0.33378556,-0.521038,-0.037785336,0.99880475,-0.23936386,-0.9605327,-0.9952992,0.002535673,-0.17241195,-0.3282857,-0.16408208,0.65752107,-0.5768719,0.5973707,-0.6397135,0.45507675,-0.64794856,-0.37184206,-0.19236277,-0.11482865,0.57138896,-0.9453631,-0.85031146,0.018877693,-0.20909587,0.11393923,0.5400834,-0.9994428,-0.3225151,-0.3838293,-0.78155607,-0.12701356,0.06968175,0.20443834,-0.6185044,-0.24414481,0.616194,0.6249217,0.32512674,-0.11793727,-0.2565186,0.052657075,0.69093966,0.95541275,-0.09709661,0.5673755,-0.10758077,0.49708256,-0.16386469,0.2515321,-0.2553909,-0.46351746,0.75936973,0.46773532,-0.041869614,-0.93529236,0.48191538,0.1471014,-0.2364431,0.28921133,-0.041314732,0.6543214,0.7287778,-0.11043498,0.23898026,-0.4463844,-0.000767307,-0.18583234,0.23109949,0.5418542,-0.96267,0.08378014,-0.09087632,0.2654018,0.41534144,-0.23650815,-0.47117096,0.67468137,-0.123723164,-0.6190189,-0.71041715,0.060947075,-0.49135187,-0.2817358,-0.10557378,-0.08392064,0.33427858,-0.24335732,0.59139085,0.17103222,0.33566377,0.18622155,-0.33471677,0.42532337,-0.20567681,-0.24013613,0.23681626,-0.99842983,-0.045280635,0.3622449,0.114127934,0.068074994,-0.2916949,0.266347,0.19423606,-0.2573784,-0.7832643,0.46457037,-0.11106761,0.15256259,-0.10224808,0.68852836,0.31727123,0.79208845,0.7613759,0.24777386,0.10406514,-0.870106,0.6998282,0.38186964,0.17715825,0.9433829,-0.13443045,-0.4618918,-0.53503484,0.10276239,0.37461564,0.9997214,-0.33264777,0.56456107,-0.18434967,0.32568312,-0.49759555,-0.14502981,0.95968455,-0.023739638,0.32900578,0.9996854,0.6739112,0.80711603,0.019095674,0.33171007,0.997833,-0.1773003,-0.39344752,0.02691086,0.3265414,0.79331505,-0.71719927,0.57327235,-0.2255746,-0.06288223,0.9951056,-0.06412769,-0.57975,0.45335177,-0.38530234,-0.33547753,0.41623712,0.07102638,-0.96215427,0.30782825,0.44862136,0.21283028,-0.99999666,0.44327602,0.2438725,0.34296712,0.29798666,-0.7414768,-0.31610623,-0.2720297,0.3822182,-0.84918886,-0.59047407,-0.22363913,0.28457835,-0.08439112,-0.26309204,-0.7630596,0.12854418,-0.91118604,-0.28927886,0.07449624,-0.60344964,0.4653038,0.82019395,0.32485893,-0.6471262,0.7069208,0.62354594,0.054647326,0.6203923,-0.5522558,-0.5081789,0.90765595,-0.9954335,0.42900944,-0.6113746,0.033616006,-0.2290105,-0.04038304,-0.34520632,0.9965687,-0.07440304,0.5039959,0.42813674,0.19913791,0.20114379,-0.3633767,-0.08501771,0.2101225,-0.48869488,-0.58753484,-0.2052002,0.42002478,-0.35586062,-0.1210033,0.45481914,0.92198646,0.1520595,1,-0.31597137,-0.49444172,-0.44280803,-0.19523409,-0.893639,-0.3484852,0.007631421,-0.778696,0.5910927,-0.42951715,0.25270322,-0.716049,-0.26999944,0.7909202,-0.29127806,-0.71858025,0.20991859,0.5547019,-0.59406716,-0.7224078,0.7211635,0.78663874,0.83065104,0.66451406,0.6603513,0.23145233,0.14148033,-0.11413489,0.039906245,0.154855,-0.114589706,0.9995564,-0.059307862,0.29861802,0.86187565,0.2914072,-0.085981995,0.7337422,0.5722011,-0.37757272,1,0.35917625,-0.97016096,-0.23073468,0.99851495,-0.6610001,-0.07172277,-0.9999577,-0.74646616,0.6034481,0.79209524,0.22508459,-0.8606909,-0.3508276,-0.31532568,0.84955287,-0.030676587,-0.5482746,-0.27291015,-0.40047047,-0.3269777,-0.507575,-0.99997133,-0.999812,-0.99638337,0.79444414,-0.48314893,0.43553567,-0.18028069,-0.04229721,-0.83984417,-0.000102518,-0.085266374,-0.11481874,-0.81649315,0.29486856,0.2231282,-0.33172792,0.22812724,-0.10329038,-0.076365724,-0.98949,-0.99998087,-0.34317628,0.45952582,-0.59045994,-0.54742986,-0.001293316,0.23007919,0.68778753,-0.00593926,-0.58361137,-0.17804544,0.05333921,-0.203408,0.91567415,0.5101331,0.81380516,0.020381732,-0.113128625,0.33116266,0.56033677,-0.4154417,-0.101552196,-0.03631335,0.8637671,-0.40314758,-0.39569926,-0.35849845,0.52900004,-0.60470027,-0.6325103,-0.464482,0.6174717,-0.06406768,-0.18150795,0.38943025,-0.76045835,0.29519913,0.32775077,-0.8755077,0.50625783,-0.7307896,0.9959874,0.48492253,-0.3080859,-0.29046428,0.16166067,-0.6084075,-0.347898,0.35192266,-0.05850529,-0.78450197,-0.6606831,0.7529836,0.14563918],
    [59,1,"C=CCOC(=O)c1ccccc1C(=O)OCC=C",0.98089385,-0.3532291,-0.08835418,-0.07431309,-0.027741352,-0.03724847,-0.106947176,-0.5239685,-0.2666435,0.23042867,0.5170591,-0.38177344,0.21185784,-0.26358905,-0.59743375,-0.12288266,0.56293905,0.42711988,0.29776612,0.48939708,0.24409197,-0.5645768,-0.22379598,-0.000889767,-0.62663746,0.6140014,0.1889721,-0.27674705,-0.24376176,0.5239447,0.6491302,-0.47697356,0.13490456,0.025328053,0.64276016,-0.10109091,-0.089315325,0.31578746,0.9897626,-0.21497151,-0.9412681,-0.4779986,0.28846708,-0.332599,-0.29287246,-0.9275525,-0.34771374,-0.5138168,0.9973033,0.48763612,-0.31555894,0.025630321,-0.36165875,-0.18538027,-0.29357266,0.0863116,0.33182874,0.5115585,0.6423159,0.060593575,0.21119007,0.53313226,-0.10890154,-0.46920872,0.15382466,0.6013148,-0.33774987,-0.6128156,0.46171838,-0.23391947,0.6917675,-0.99118257,0.37053153,0.017897727,0.25254163,0.08115608,-0.6914639,-0.121064596,-0.16889103,-0.9999682,0.091369264,0.146772,-0.7871668,0.03318149,0.115951486,0.29412305,0.009662931,0.23046331,-0.5259781,0.43952852,-0.060186144,-0.459503,-0.3583144,-0.0129663,0.999502,-0.45441747,-0.006339567,-0.36539543,-0.20000449,0.39154655,-0.010176387,0.27064264,0.14004552,0.088978805,-0.81522465,-0.85567105,0.17058125,0.12272074,0.9953931,0.47405648,-0.121904865,-0.12350628,-0.5432761,0.03175204,0.2309678,0.375573,-0.022716567,0.027589932,0.9973671,-0.23765837,0.5272777,-0.6062261,0.21426138,0.08867622,-0.21488413,-0.14829428,-0.38880542,-0.47204715,0.2115433,0.9953614,-0.18214916,0.09390173,-0.002000709,-0.34816474,0.16682896,-0.96744543,0.38151816,-0.15053973,-0.5242054,-0.38958228,-0.9889117,-0.1676625,0.8074671,0.66026884,0.41852483,0.64019805,0.1628888,-0.5069097,0.06897096,-0.37528637,-0.59404075,-0.91958076,0.2558575,-0.25842723,-0.45733154,0.059805986,-0.42947075,0.94303095,-0.714747,-0.89718604,-0.9640555,-0.43930387,-0.5009146,0.5146011,-0.30304578,0.41368872,-0.32536715,0.758683,0.06158619,0.7596167,-0.40312496,-0.15139067,0.50111955,-0.41126302,0.61846733,-0.93011856,-0.40766567,0.061543982,-0.32099622,-0.08076423,0.4308401,-0.99216664,0.43763572,-0.33941224,-0.2274766,-0.5670686,0.45867857,0.17596832,0.19779958,-0.26422516,-0.011419139,-0.27256313,0.10514419,-0.4957104,0.51397943,-0.28636086,0.35637122,-0.9529207,0.32523048,0.12693518,0.28358328,-0.07600734,0.55412775,0.60403836,-0.07103308,0.37723884,0.659461,0.25994644,0.005718306,-0.9998615,-0.37074068,-0.35944232,0.116245046,0.19507973,-0.5624987,0.49128413,0.5009703,-0.09873649,0.3859984,-0.005346426,0.10411219,0.12848991,-0.13733095,-0.5070325,-0.9873187,-0.50896835,0.017010184,-0.40938532,0.012872229,0.4226508,-0.22057039,0.65237314,0.16708504,-0.3479729,0.52949107,-0.028464599,-0.90092707,-0.17821313,0.18880954,0.5478743,0.92721754,0.38104934,0.3884718,-0.5923114,-0.047146518,-0.6925844,-0.2519185,0.5939452,-0.016586512,0.006342503,0.47982395,-0.9974743,-0.42675143,-0.07878527,0.329963,-0.21547036,0.4918432,0.4673812,-0.57014054,-0.16404085,0.16649075,-0.10338288,0.24143282,-0.18664631,-0.6275891,0.7398108,0.1524429,0.066581845,0.8243386,0.15434541,0.4075222,0.8413443,-0.41362736,-0.709462,-0.26111168,-0.87414455,0.5521204,-0.15988106,-0.14221345,0.86010695,-0.11322202,0.99828404,-0.24140446,-0.55002964,-0.01858719,0.4150524,-0.10500991,0.12241601,0.71373874,-0.54026455,0.503178,0.99297047,-0.004399528,0.9305427,0.26837167,-0.22089353,0.99598247,-0.87397796,-0.31332812,-0.7791938,-0.20698434,0.60619575,-0.3129419,0.49458006,-0.5734772,-0.81129843,0.3539801,-0.51943225,0.06325447,0.2359754,0.022839824,-0.25727066,0.07662552,-0.17298745,-0.6087878,0.09450655,-0.46883526,-0.45999253,-0.99989796,0.07268631,-0.09880057,0.58765984,0.17456524,-0.26934895,0.48874813,0.23254576,-0.23852138,-0.72571474,0.6579075,-0.038470224,-0.16531774,0.54919446,-0.38297707,-0.35445786,0.599627,-0.66324186,0.8036582,0.089175284,0.115834594,-0.7128154,0.6193943,0.3008957,-0.46111074,0.8757448,0.111245364,-0.29764247,0.018193616,0.17190853,-0.77181864,0.3915538,-0.9789569,0.61770296,-0.26695192,-0.77741975,0.72812456,-0.2717939,0.3205385,0.99930155,0.37853217,0.45045376,0.1160377,-0.03061261,0.5126854,-0.6824891,-0.37767324,-0.14650548,-0.6290261,-0.06786711,0.14686511,-0.028749969,-0.69553995,-0.13096933,0.104194045,0.6743523,-0.486896,1,0.05363075,0.73552024,-0.18896869,0.12443314,-0.8355057,-0.59049225,-0.5204045,-0.28861177,0.7501067,-0.31054235,0.06760278,-0.07136824,0.39793906,0.5075153,0.53956455,0.13584675,-0.34090832,-0.6969415,-0.23822428,-0.9453059,0.14262025,-0.28736693,0.14058203,0.17201664,0.5183193,0.34660608,0.29264286,-0.12387086,-0.40937063,-0.709498,0.22977675,0.56767064,0.29178613,-0.19365321,-0.73926044,-0.11991312,-0.44124174,-0.3442192,-0.263584,-0.48746532,0.99999976,-0.3635212,-0.9810205,-0.15182829,0.9991671,-0.7077308,0.7901246,-0.9998921,-0.18880707,-0.6892011,0.21997675,-0.6631254,0.17514619,0.30957103,0.21883446,0.2863428,0.59179074,0.8167424,-0.051217984,-0.036891855,0.08159312,-0.6994701,-0.999908,-0.997403,-0.957315,0.540375,-0.3706963,-0.119532175,0.49492553,-0.064699635,-0.5034346,-0.47028258,-0.22798777,0.41514546,-0.81976974,0.3686718,0.1578269,0.09874095,0.5526824,-0.049301375,-0.52551055,-0.683368,-0.99977607,-0.2364733,-0.39512607,0.24859644,0.032722745,-0.3548177,-0.554086,0.61479443,0.42605922,0.08704949,-0.19947515,0.4965398,0.16578402,0.91632557,0.32165587,-0.2945695,0.14913388,-0.32262772,0.46150887,0.112998135,0.13218044,-0.042179704,-0.14073248,0.5397709,-0.9631976,0.6223023,-0.21008812,-0.3085057,-0.46211797,-0.005569975,-0.20190412,0.44778755,-0.27957234,-0.046685643,0.37803295,0.9152622,-0.42584977,-0.5437835,-0.19024867,0.3487777,-0.40301806,0.99983716,0.42010775,-0.8040405,-0.06292236,-0.45975932,0.5745487,-0.12757508,-0.98079664,0.113077655,-0.091491245,-0.3971662,0.012337251,0.19614123],
    [60,1,"CCCSP(=O)(OCC)SCCC",0.91798675,0.107134,-0.7505082,-0.2602021,0.63370436,0.24763481,-0.94609946,-0.02663161,-0.48121396,0.38722065,-0.89512813,-0.01173867,-0.5473523,-0.18125741,-0.08961541,-0.64737403,-0.3371374,0.14541264,0.41231567,-0.40163064,0.56396383,-0.12963209,-0.4224395,-0.11699629,-0.3394834,0.49705482,-0.5504557,0.14165652,0.29471305,-0.5022733,-0.18584344,0.011185848,-0.50780445,-0.32094726,0.47094434,-0.69974715,-0.026243422,-0.2130349,0.6932269,-0.85769486,-0.957759,-0.12307751,-0.058573294,0.63330805,0.05946565,-0.98401505,0.023791252,0.512413,0.99830836,0.46568438,0.22664711,-0.007314946,-0.14049073,0.34059128,-0.8650911,0.24019264,0.6192918,0.90883505,0.527872,0.34773937,-0.1869138,0.67718655,0.039664507,0.2028352,-0.20201765,0.735825,-0.4572734,0.014665265,0.10039596,-0.1612738,0.85635173,-0.80697286,0.091994636,0.8527977,0.10511256,-0.7625126,0.4916664,-0.49708366,0.039411306,-0.9993314,0.23308599,0.22932543,-0.20812653,-0.34111392,0.29996836,-0.33402893,0.098170415,0.6974707,0.39582512,-0.020662969,0.42960885,-0.6289234,0.051708523,-0.22143935,0.96712965,0.119468026,0.18491155,0.065150425,0.59943485,0.38290524,-0.33303812,-0.43230972,0.40089005,-0.77638996,0.68505025,-0.89579886,0.35100368,0.028497199,0.9967566,0.47719866,0.054694887,-0.24693447,-0.65378314,0.33406165,-0.13813157,-0.13181251,-0.54216135,0.33257467,0.9988806,0.11119818,-0.4115552,0.17090409,0.2889274,-0.14696857,-0.4276156,0.6171021,0.23344812,-0.71977174,-0.6441051,0.9994935,0.44064692,-0.047823194,0.22441171,-0.23668736,0.5273766,-0.97092116,-0.5075592,0.17452647,-0.44525802,0.1060986,0.9996232,-0.20870903,0.97490096,-0.552954,-0.45628724,0.036903474,-0.48766762,0.48048687,0.9330108,0.5366698,-0.143006,-0.8682793,0.27100295,0.03648636,0.18974514,-0.34290227,-0.68554306,0.997555,-0.90907127,-0.98365504,-0.960269,-0.67730117,-0.50505364,0.5401715,-0.13048008,0.3429826,-0.049691103,-0.15604866,0.3325969,0.010973041,-0.34959313,-0.011590086,0.6982604,0.118546404,-0.46768257,-0.8474964,-0.6204479,0.20710087,-0.69879353,-0.14411353,0.21213834,-0.8761807,0.71539813,0.2879216,-0.7594066,-0.11035814,0.5859028,-0.49713323,-0.4645801,0.041877765,0.0992369,-0.21375301,0.06349218,0.34071678,0.03988326,-0.28808016,0.46289438,-0.7471826,-0.05898497,0.12070152,-0.39479476,-0.4939392,0.4204853,0.21064712,-0.7027755,-0.20655385,-0.025389047,-0.55312407,0.32075533,-0.99269885,-0.38111028,0.365561,0.039289683,-0.18330824,-0.006120426,-0.10020552,-0.6936901,-0.25113556,-0.55619335,0.14833724,0.30956638,-0.10517011,-0.114795305,0.258935,-0.9833929,-0.036747914,0.52223927,0.18350339,-0.19587392,0.052348725,-0.6269731,-0.11791185,-0.2297223,0.08774923,0.2552887,0.35957965,-0.2453096,-0.5831609,0.058517084,0.5219271,0.83007187,-0.46368557,0.16818324,-0.05699732,-0.4095302,-0.31043145,0.32733884,-0.69893444,-0.48621064,0.13394636,0.55578035,-0.999783,-0.8123486,0.43538335,-0.382577,-0.6021943,-0.12144289,0.51155025,-0.537148,-0.3740674,-0.5754983,0.44641283,0.5527016,0.32196957,-0.4481725,0.021799508,-0.38631895,0.023481144,0.84143627,0.0239128,0.47785395,0.97687304,-0.59364974,0.35676432,0.49170196,-0.87409824,0.42389107,0.25568342,0.25750953,0.87292314,-0.22874746,0.99773973,-0.5511923,-0.017522238,-0.7387683,-0.26506516,0.39876935,0.71216434,0.8225746,-0.82093894,0.66994613,0.99900645,-0.3823641,0.9539271,0.64345586,-0.18819948,-0.9974325,-0.96889126,0.2947669,0.5721672,-0.6168703,0.61181617,-0.05054366,-0.17925087,-0.10499587,-0.34615982,0.99184793,0.26073566,0.10442515,-0.34162343,0.6877495,0.48405504,-0.19664338,-0.025597084,0.2807024,0.6645754,0.086951904,-0.56334424,-0.9999785,-0.40919808,0.27242914,0.54785585,-0.13613819,-0.9223367,0.8483915,-0.72857684,-0.20688903,-0.8280881,-0.0800659,-0.072442114,0.22402352,-0.10552205,0.47288957,0.018386768,0.23891589,0.68535334,0.46870342,0.19321963,0.6225753,-0.51045126,-0.07109579,0.15561365,-0.36671248,0.785688,0.50333494,-0.6125886,0.16998945,0.6683236,0.32310054,0.824621,-0.98647714,-0.63119006,0.49514776,0.50493246,0.09284017,0.38755637,0.070030466,0.9996166,-0.3834467,-0.000622062,-0.23374586,-0.52350634,0.5191996,-0.5998101,-0.36708915,-0.100728534,-0.2596768,0.25006852,-0.1306817,0.44387063,-0.005687006,0.3976917,0.2305228,0.72459507,0.19332562,1,-0.10600243,-0.003836594,0.20832594,0.44791737,-0.72441196,0.7539019,-0.4657349,0.52225894,0.8087432,0.6720908,0.24839097,0.6041404,-0.52798,0.3671496,0.14788228,0.20544146,-0.26591897,-0.7094562,-0.051502455,-0.88987064,0.42061588,-0.68120146,0.6221578,-0.40342447,-0.69565976,-0.07039833,0.09848692,0.12839006,0.37529588,-0.019978708,0.43375707,0.20145608,0.5064277,0.17457992,-0.51206374,0.7215383,-0.09637418,0.025133088,-0.037151426,-0.016060488,0.99999994,-0.4134284,-0.648661,-0.42497805,0.9974657,0.14932063,-0.6105073,-0.9999741,-0.28646913,-0.6090375,0.40014988,-0.24589753,0.47268128,0.059093453,-0.43813398,-0.07687937,0.04291585,0.778692,-0.63141274,0.4428044,0.15474075,-0.20756835,-0.9998404,-1,-0.99636173,0.48491955,0.36313206,-0.7492889,-0.14954415,0.7019771,-0.1703582,0.47693813,0.5842653,0.6570661,-0.36841395,0.0353243,0.11603001,-0.7261451,0.8309527,0.40761465,0.6340972,-0.9776853,-0.999268,0.34644878,0.30521336,0.5638159,-0.2091876,-0.30913803,-0.94663286,0.37317988,0.68826836,-0.019358203,-0.04793587,-0.8617492,-0.07503535,-0.7195649,0.5529255,-0.55642533,0.30613977,0.5767733,0.18880728,-0.34883854,-0.24036944,-0.23903884,-0.6767307,0.5262707,-0.9980543,-0.02135928,-0.5108204,-0.18091568,-0.3693637,-0.34583125,0.25297922,0.11034795,-0.042587027,0.60816586,0.3620203,-0.6600976,0.22362083,0.032467,0.27560213,-0.028599802,0.04062865,0.99974763,0.2014058,-0.62431896,-0.04914703,0.28302288,0.48019728,-0.13295363,-0.5162723,-0.3741093,0.33179662,0.1084425,-0.09944531,-0.13839872],
    [61,0,"CC(C)OP(=S)(OC(C)C)SCCNS(=O)(=O)c1ccccc1",0.85327846,0.21508057,-0.52168167,-0.019049086,0.23071685,0.2406472,-0.96469295,0.6517192,-0.43028864,-0.46349514,-0.65746915,-0.023200054,-0.62318355,-0.19827428,0.17306988,-0.44775537,-0.75111985,0.05260907,-0.28807667,-0.617916,0.42776608,0.43062526,-0.48051026,0.23556383,0.4175323,0.07128967,-0.70483965,0.43621337,0.29647234,-0.1694701,-0.08029283,-0.71460813,-0.62024057,-0.5686717,0.37251133,0.38658488,-0.11543732,0.2529047,0.999391,-0.55224216,-0.8865331,-0.21988073,0.3195101,0.23508804,-0.26548076,0.088826984,0.046049047,-0.35192752,0.9795668,-0.65444285,0.15924048,-0.77896935,0.25692418,0.583334,-0.12604205,0.7286713,0.43107042,-0.64613545,-0.017560907,0.6496444,0.31101754,0.6729155,-0.08113476,0.22516353,-0.8353397,-0.2959367,0.50785136,0.006344979,-0.008813607,-0.1976341,-0.48171136,-0.9430192,-0.4812915,0.67273134,0.02133352,-0.8635781,0.75534797,-0.82936126,0.3839347,-0.9997904,0.20997295,-0.22704878,-0.8527247,-0.561366,0.622334,-0.76986736,-0.15039417,0.5855971,0.025988966,0.18263415,0.13374378,-0.46846095,-0.034127906,0.12680723,0.99977046,0.5699707,-0.27140957,-0.3683119,-0.16565062,0.007065404,-0.3733522,-0.12066398,0.25050622,0.92838895,-0.99556154,-0.89232147,-0.10058193,0.8679899,-0.9478929,0.7111064,0.5729298,-0.09222897,-0.53809,-0.59651124,0.35770056,0.6123021,-0.40185288,0.6868957,0.9823837,-0.3025263,-0.54764146,0.27725127,0.5981303,-0.2133467,-0.45699948,-0.1627492,0.29645807,-0.2503768,-0.24743447,0.9984527,-0.018266113,-0.45716867,0.056472518,-0.17577358,0.13047394,-0.9718575,-0.54772824,0.24059239,-0.3688962,0.31485316,-0.99734414,0.12989357,0.29281303,-0.23252891,-0.088658355,0.3118981,-0.61130047,-0.43402043,-0.9599342,0.4123616,0.36059427,-0.1789956,-0.19323847,-0.15561095,0.64925224,-0.25920033,0.5940644,0.16629797,-0.76966316,0.31331635,-0.5455522,0.02920379,-0.27874908,-0.17321302,-0.5816772,-0.6540429,0.039786007,0.856844,0.3428679,0.5563519,0.16660248,-0.6406036,-0.016810348,0.34758818,-0.4317434,-0.77198833,-0.22772904,0.57214373,-0.7565836,0.57263464,0.19614401,-0.9871469,0.4607693,0.78533345,0.5679054,-0.19578706,0.7796117,-0.2761768,-0.25828993,-0.6934665,-0.4474353,-0.4506804,-0.026283097,0.65799683,-0.61619866,-0.19138739,-0.3087486,-0.9324099,0.39962798,-0.20518081,-0.06742289,0.3719208,-0.51786053,0.16129895,-0.5901106,0.42923662,0.1064977,-0.60591894,-0.014189545,-0.9998989,-0.46632156,0.5799117,-0.52582777,0.08833755,0.5212327,-0.34413487,-0.6465124,0.25114867,-0.8544099,0.52542645,-0.23041667,-0.5133173,-0.5437671,-0.31761682,-0.98012865,0.2513864,0.24710412,-0.8047385,0.002559077,0.574237,-0.35703656,-0.26124817,-0.14445558,0.21790443,0.27077138,0.33741516,0.22069365,0.6817359,0.39775825,-0.49633813,0.6707587,-0.15949637,0.018746633,0.006698583,-0.107841626,-0.7177476,0.6337552,-0.6023344,0.016054612,-0.30684638,0.6738222,-0.9978056,-0.5643404,0.3293622,-0.051186584,-0.11859171,0.2808041,0.66821194,-0.1122588,-0.5572458,0.2305699,0.12421299,0.5559993,0.5313115,-0.30306438,-0.33134422,0.014597503,0.20068371,0.56179196,-0.30158767,0.5180634,0.9982415,0.24837157,0.77299875,0.8637959,-0.5463231,-0.21561009,-0.04892863,0.08521545,-0.08887541,0.23365901,0.9903848,-0.7012062,-0.5102409,-0.85434717,-0.44668627,0.53786755,0.59327227,-0.95910674,-0.7299138,-0.054654166,0.9139495,0.64069754,0.25527328,0.7138897,0.24957253,0.99152064,-0.9121275,0.3449204,0.37160715,-0.6954797,0.7264431,-0.3078316,0.026357178,-0.29421562,0.46086556,-0.89507926,0.18316697,0.748715,0.10114029,0.38794857,0.4475034,-0.2362632,0.23370773,-0.75566417,0.575051,0.24702378,0.74979055,-0.94502103,-0.071470626,-0.5095686,0.3131053,-0.5291293,-0.7714111,0.66512203,-0.3960124,-0.40631798,-0.68690896,0.49736795,0.8201943,0.4009993,0.5229849,0.6629259,-0.10009619,-0.4004102,0.097076274,-0.17272949,-0.17185268,-0.5118562,-0.13780107,-0.5612972,-0.40393034,-0.51900345,0.5225442,0.364976,0.11819774,0.4764914,0.7698715,-0.08415186,-0.8717021,-0.8467534,0.1353444,0.47645018,0.14227164,0.6793258,-0.17462347,0.764393,0.9999343,0.36042768,0.5691202,0.5896892,-0.03721811,0.2650581,-0.7342431,-0.21013662,0.51170254,-0.45364663,0.10015128,0.027870463,0.69087964,-0.041795082,0.501875,-0.2382621,-0.21732686,-0.07783224,0.99999994,-0.035164107,0.14098537,-0.117202744,0.13460696,0.08640771,0.17989211,0.5980698,-0.09402821,0.13838044,0.5619443,0.083719924,-0.07716675,-0.39392573,0.36441544,0.2984443,-0.32131925,-0.4460551,0.13025847,0.22823893,-0.9462783,0.08794965,-0.2822453,-0.6577494,-0.39765933,0.9258315,0.35950327,0.57978714,0.25217736,0.34493488,0.33424184,-0.074689545,0.21034604,0.25477698,-0.43563434,-0.6057277,0.533042,-0.22824314,0.21445405,-0.35386506,0.006477089,0.9999097,-0.6048848,-0.97792554,-0.032088313,0.99983114,-0.3772973,0.1936375,-0.9988456,0.06045092,-0.9261121,-0.66925853,-0.68485785,-0.40325448,0.025082152,-0.1055946,0.49077135,0.3110149,0.35870555,-0.6443714,-0.31932712,-0.08713088,-0.29313964,-0.99982476,-0.99619925,-0.43592864,0.2040902,0.29818037,-0.21404487,-0.42221424,0.25894266,0.3271393,0.51281327,0.509326,0.5525908,-0.42844847,0.070107855,-0.27105168,-0.09278062,-0.15274508,0.061680105,0.3644418,0.6828316,-0.999024,0.11757497,-0.018386936,-0.14275508,-0.8264565,-0.6709607,-0.32803383,0.74823755,0.80582505,0.41663957,-0.16901995,-0.8904261,0.2356449,0.79714125,0.5088027,-0.18119632,0.42275527,-0.4610332,0.4483682,0.5245919,-0.019551847,0.33267352,0.47929537,0.4872911,-0.9947995,-0.6095977,0.006605488,-0.8067549,0.27883708,-0.24786218,0.028190287,0.36732197,2.06e-05,0.45051137,0.4401466,0.9916222,0.4715405,0.5262391,0.611477,0.027392587,-0.7390269,0.9999321,0.67287606,0.08166985,0.41992664,0.05945163,-0.090249546,-0.3188008,-0.9946339,-0.18925895,-0.03690845,-0.5516122,-0.12265537,-0.19268447],
    [62,0,"O=C(O)COc1ccc(Cl)cc1Cl",-0.67980015,-0.30929798,-0.5628282,0.47179914,-0.009820146,-0.48622674,0.08302871,-0.23942235,-0.09881385,0.028856602,-0.20361339,-0.01952686,0.114413545,-0.52641886,0.12875766,-0.2433338,0.49184468,0.410406,0.76439995,0.25188607,0.3833048,-0.8298175,0.054789152,-0.15248123,0.118288174,0.1376041,0.3066179,-0.13764393,0.30743724,-0.15259627,-0.00697563,0.50991476,0.20573683,-0.27379894,0.32813314,-0.41067266,-0.21126105,0.27414614,0.3801192,-0.91288877,-0.99813575,0.27238557,-0.09892053,0.3924303,0.30927667,-0.994423,-0.07018752,-0.18133202,0.8242027,-0.09299895,0.430736,0.2735213,-0.23027201,-0.12162231,-0.7621896,-0.087738745,-0.28250483,0.9416178,0.16709839,0.28674442,-0.16875325,-0.032598544,0.42123702,-0.016974865,-0.35375854,0.5301894,-0.037510995,0.16547732,0.21349008,-0.5448627,-0.7089532,-0.9870966,0.00761813,0.1658511,0.42760825,0.5136388,-0.40238026,-0.16614394,0.05631397,-0.9988215,-0.4004314,-0.3452002,-0.7290206,-0.5428877,0.5867573,0.1831477,0.42813978,-0.024878332,-0.26622045,0.11519281,0.000303809,0.7379158,0.105191804,0.19986436,0.9842945,-0.2984041,-0.026317017,0.20815767,-0.050192814,-0.33155373,0.6718985,-0.37907633,0.04921552,0.14992799,0.8768187,-0.5155739,0.14853996,0.17842184,-0.9019125,0.16888274,0.17932296,-0.5345002,-0.17117184,-0.55146295,0.039595842,0.28883004,0.5525905,0.7127561,0.99921983,-0.24733396,0.058410574,0.06534317,-0.181735,0.24359769,-0.16144675,-0.06977021,0.10808032,-0.052503303,-0.04884378,0.9989538,0.2684241,-0.3201913,0.43117797,0.023420906,-0.111259304,-0.5906624,-0.23633005,-0.22460783,-0.54808384,-0.019338327,-0.9978746,0.011584765,0.9716889,0.11622112,0.40148073,0.6372975,-0.19613646,-0.4258973,0.9939747,-0.13716155,-0.1934309,-0.35292563,-0.2608894,0.40637484,-0.41490686,-0.060098864,-0.15542434,0.99862003,-0.37629944,-0.686376,-0.9890141,0.10986505,0.19528912,0.41939282,0.49429163,0.5408419,-0.36721277,0.45612726,-0.6525435,0.47692466,-0.51455826,-0.18451019,-0.29618582,0.06709649,0.6282293,-0.9692259,-0.63218594,-0.019473467,-0.36693084,0.32623196,0.40319857,-0.80758005,0.059611827,-0.27713606,-0.90533805,-0.41318873,0.2471322,0.09893283,0.21219209,0.051565297,0.14033483,-0.38729858,-0.05458723,-0.09732206,0.005241565,0.2323743,0.623318,-0.6059715,0.11995477,0.37025836,-0.6468604,0.16730891,-0.28602973,0.31462595,0.7001076,0.010798564,0.6064165,-0.29786894,-0.27424723,-0.9685602,0.45896187,0.42927688,0.13643414,-0.32242677,-0.5493057,0.3510598,-0.015944673,-0.11988484,0.23281214,-0.49652052,-0.3938522,-0.10086688,-0.41905233,-0.17571902,0.99670637,-0.2241115,-0.26790413,0.30418777,0.059424765,0.10818133,-0.030176261,-0.06173028,0.003088181,-0.27674454,0.4614075,-0.47972307,0.022488248,0.20338848,-0.16371754,0.25146365,0.9146903,-0.060708508,0.07450453,-0.51521784,0.65689474,0.08779392,0.18358813,0.34055787,-0.14518347,-0.08167345,0.42091367,-0.998229,-0.31284112,0.47217456,0.23624071,-0.56936306,0.21743377,0.37083447,-0.42551896,0.21919361,-0.108686075,-0.1347265,-0.017456662,-0.7086121,0.65433633,0.055752143,-0.5401221,0.36443138,0.39719015,0.118453145,0.54523087,-0.67482555,0.35701218,0.07670234,-0.112039596,0.8931023,-0.22503173,-0.38397548,-0.32815492,0.39297235,0.24982995,0.9994902,0.331592,0.4727634,-0.044495318,-0.21829599,-0.3334731,-0.5750796,0.60002154,0.1985315,-0.13102527,0.9994655,-0.32051954,0.6035188,-0.082450286,0.49507496,0.9983929,-0.8722926,0.27395374,0.30054852,0.1155187,-0.21981265,0.034533873,0.08130011,-0.20731992,-0.22143584,0.9908496,0.21431787,0.09412061,0.124733575,0.31546953,-0.25160518,-0.43476114,0.44519123,0.46644625,-0.3580097,-0.15064001,-0.25380248,-0.9688965,-0.2434409,-0.46275824,0.3245142,0.4964651,-0.69350296,-0.26993036,0.37990358,0.13696639,-0.9665342,0.56224996,-0.08419269,-0.096550055,-0.2586613,-0.033412125,-0.24392271,0.4815202,-0.442845,-0.14639121,0.39327928,-0.3528945,0.43073943,0.29039302,-0.49884972,-0.18274735,0.76214296,0.37211692,0.10394087,-0.03154323,0.24280527,-0.24477789,0.84357375,-0.9964884,0.23666672,-0.05610085,-0.22529422,-0.024342246,-0.014371271,-0.12636232,0.9983793,-0.061332174,-0.06987049,-0.06271664,0.3013487,0.60156375,-0.05273601,-0.67843294,-0.18702152,0.5617557,-0.39623305,0.20345713,-0.10279275,-0.36357516,0.2569675,0.005432033,0.8798126,0.38756964,1,0.2277453,-0.55068034,0.08629464,-0.6129054,-0.79324746,-0.38172573,0.38960364,-0.28954807,0.21967699,-0.3158847,-0.1217107,-0.028042428,-0.20509027,0.504256,-0.22892645,0.43358228,-0.5768391,0.3910443,0.44187805,-0.34828916,0.37417305,0.29872578,0.21569306,0.039248865,-0.6539322,0.31962058,0.058072403,0.4727431,-0.117880754,-0.13384238,-0.69914055,-0.001512459,-0.49424103,0.28895083,0.1122929,0.6167404,0.5136364,0.14835308,0.11209793,0.010547025,0.99996084,-0.15405056,-0.99712235,0.019867172,0.9996055,-0.69593143,0.005648659,-0.99797976,-0.117026396,0.29086858,-0.010262709,-0.10780788,-0.24029577,-0.167925,0.36736125,0.47438294,0.1519227,0.459104,0.021551736,-0.001729309,0.12007713,0.0606713,-0.9999694,-0.9993727,-0.9900435,-0.08008629,-0.27521002,-0.3903817,-0.038369212,-0.42050818,-0.6592492,-0.17471924,-0.46596128,0.15320617,-0.7243086,-0.00380981,0.40341577,0.46338677,0.094693914,0.3003601,-0.37679827,-0.97590417,-0.99989516,0.12662593,-0.2363297,0.30234393,0.30244356,0.40455216,-0.96335655,0.11105552,-0.26349986,-0.26976776,-0.07338366,-0.40746126,0.3778414,0.95715946,0.08345719,0.940471,0.27062702,-0.3854309,0.062297072,-0.73294294,-0.29729486,0.22153394,-0.13246304,0.044381063,0.8933976,0.62831545,-0.4628712,-0.12223909,0.12450497,-0.74257636,0.5371889,0.47476962,-0.5945262,-0.018520685,-0.25173998,-0.6334562,-0.1380456,0.20342316,-0.112427294,-0.04184042,0.39511538,0.99991274,0.67538434,-0.14023937,-0.3855401,0.14913651,-0.10671945,-0.055033058,0.14749223,-0.024769757,0.4872349,0.3845172,0.6146727,0.21240433],
    [63,1,"N#CSCSc1nc2ccccc2s1",0.08572501,0.5745101,-0.4345135,0.008634659,0.20380871,-0.5558689,0.039483964,-0.11849845,-0.29524273,-0.43075514,0.3623178,-0.08298256,0.4813628,-0.74327344,-0.09144798,0.37388235,0.38249347,0.7312847,0.33672577,0.39464244,0.58135605,-0.38120002,0.024453811,0.04600204,0.22195883,0.5720854,-0.21741164,0.052872933,-0.4107253,0.14806892,0.5444587,-0.003342891,-0.06013051,-0.15817404,0.46456283,-0.19424658,0.43407854,0.14287867,0.7863871,-0.96914214,-0.98630536,0.29537445,0.062943555,0.48318684,-0.55489624,-0.9814804,0.033885505,-0.56578124,0.98212206,0.14038388,-0.11196815,0.27736792,-0.27081743,-0.24054267,-0.72696066,-0.15557736,0.10080062,0.9174104,0.21110095,0.37504524,0.117244326,-0.16448441,0.3967387,0.025940364,-0.53542095,0.047128,0.26982337,0.038546205,0.5344695,-0.29827946,-0.420003,-0.9764916,-0.67097867,-0.6144497,0.28376082,-0.62838024,-0.14073862,-0.63586956,0.25427976,-0.99944586,0.26096854,-0.2365901,-0.84364057,-0.017707273,-0.2869835,-0.3392876,-0.43095118,-0.05367921,-0.13811892,-0.07717756,-0.4008668,-0.65384,0.26419052,-0.42350256,0.9885195,0.11446252,-0.17636164,0.54101527,-0.27632153,0.20951095,0.1216481,-0.624465,0.47309867,0.33822283,0.6335736,-0.9794513,-0.037491303,0.37049797,0.97705936,0.6248247,-0.30209666,0.09919449,-0.21409416,0.7897015,0.24295433,0.14575763,-0.07521224,0.07784471,0.9986241,-0.113492586,-0.28883126,-0.09430656,0.5863822,0.21317734,-0.19645765,0.018795494,-0.29609013,0.19271879,-0.51170975,0.99834555,0.766081,-0.20628653,0.6454574,0.11739808,0.4526922,-0.905637,-0.85037756,-0.115541294,0.5238037,-0.08759306,-0.9997607,0.23214842,0.96381956,-0.15544884,0.2411454,0.6313421,-0.47980624,-0.23413128,0.9555337,-0.023574159,-0.025185747,-0.6673165,-0.30498797,0.5726295,-0.41362998,-0.008933749,0.78178304,0.9978203,-0.10573109,-0.9529525,-0.98054826,0.21644585,0.35428065,0.37198743,0.15682636,0.5808074,-0.5860334,-0.22753225,-0.22279549,0.66083086,0.095463604,0.38241217,0.05150089,0.13761944,0.27578944,-0.42570752,-0.67894983,0.6541556,-0.64103687,0.13788311,0.6976521,-0.57709527,0.5069087,0.2908937,-0.8165529,0.019642863,0.5194554,-0.046316423,-0.50629747,0.40013626,-0.21054874,0.23931582,0.67143804,0.44067684,-0.6385415,-0.13599011,-0.16685216,-0.3081541,-0.11394245,-0.5380394,0.52619433,-0.25074616,-0.12541075,0.38524073,0.22727221,-0.7006857,-0.05506574,-0.7289261,0.4641911,-0.99530303,0.41403085,0.3487721,0.1135772,-0.038842387,0.4356411,0.07530415,-0.39976117,-0.3431434,-0.4487712,-0.24033576,-0.45012096,-0.53540707,-0.008862232,0.32424623,-0.9410075,0.080090284,-0.6703307,0.13623048,0.12337514,-0.2618775,-0.08451117,-0.023597904,0.30269858,-0.19533975,-0.11121487,0.14758354,-0.5832293,0.59726775,-0.028709495,0.4771137,0.8089298,-0.8128197,0.14517829,0.6056514,0.47948098,-0.116255246,0.5807988,-0.16717234,0.040168863,-0.3503369,-0.1675038,-0.9679635,-0.7011894,0.7770316,-0.5779053,-0.501113,-0.6553522,0.04459312,0.17567313,-0.08706298,-0.053443037,-0.8994854,0.1348888,0.5121461,-0.48774633,0.64397067,0.24175014,-0.38233823,0.73424345,0.007622221,0.7231045,0.95285153,-0.7796351,0.27519438,-0.2194845,0.87822384,-0.21987972,-0.37801117,0.3554239,0.88025117,0.5592489,0.99924856,-0.29515195,0.33993357,-0.4494066,0.3144789,0.6054209,0.473687,0.97404367,0.49100086,0.025007349,0.9993504,-0.5251232,0.54666257,0.18151206,0.24683821,0.99983203,-0.9044453,-0.03884654,0.5911616,-0.05097929,0.03427156,-0.06084318,-0.21365693,0.8357538,0.5627484,0.96843475,0.7165949,0.3583626,0.08777937,0.3699991,-0.20334485,-0.2052919,0.102793284,0.7251327,0.38345483,-0.057798907,0.34578314,-0.9999524,-0.46448088,0.12041053,0.3944486,0.12761696,-0.83014464,0.50551414,-0.3588883,0.5431649,-0.6102239,0.53522056,0.6739287,-0.14884622,-0.39019665,0.49681875,0.57651556,0.3969423,-0.19165374,-0.33806807,-0.30230924,0.17891043,-0.47942767,0.0765226,-0.041725826,-0.17465518,0.743995,-0.31365687,-0.08574296,-0.209454,0.6000169,-0.58703417,0.808524,-0.9934896,-0.5216778,0.11980141,0.76570654,0.6194772,0.55864716,-0.59678054,0.9991156,-0.10741591,0.51156586,0.13824472,-0.06588418,0.8053351,-0.58150595,-0.6738023,-0.029786957,-0.095225245,-0.7208786,-0.0601031,0.5434849,-0.32750347,0.11186745,0.14034425,0.3524247,-0.037529323,0.9989626,0.07679257,0.1562638,-0.21270189,0.18716265,-0.6508568,0.4444776,0.23066838,0.1454759,0.5915506,-0.21719955,-0.53596133,0.6034875,-0.11675094,0.7559272,0.32041878,-0.41019902,-0.4671174,0.24498796,0.19919848,-0.014536903,0.7448152,0.15199761,0.098836295,-0.67238575,-0.19836508,-0.057295855,0.58111495,0.35983878,-0.3526484,0.5327513,-0.72009987,0.50819165,0.73534393,0.47425848,0.604404,0.49078876,-0.12654057,0.09615943,-0.057615563,-0.15097508,1,-0.68888664,-0.8385528,-0.03830794,0.99830484,-0.82909596,-0.38259518,-0.9999643,0.47163618,-0.4252231,-0.004483588,0.24157703,0.07995784,-0.3278597,0.23004794,0.4317365,-0.11968576,0.32688895,-0.59406984,0.0894893,-0.084965184,-0.55671114,-0.9999331,0.9775587,-0.9812245,-0.4032531,0.25523803,0.07066521,-0.34109834,0.22111562,-0.21588202,-0.070453785,0.524826,0.5287798,0.055657174,0.27715656,-0.036011983,-0.62540716,-0.020904718,0.3268355,0.22569029,-0.9589,-0.9997391,-0.073588476,0.7461801,0.18473484,-0.4675875,0.6472798,-0.91676736,0.038289774,0.54170877,-0.32050547,0.5120379,-0.47540742,0.7871966,0.9854385,-0.26351398,0.35566854,0.8199109,0.28804377,-0.074820615,-0.06969898,-0.24654795,0.13604125,-0.71329296,0.1228922,-0.76499194,-0.41751662,0.4696602,-0.3168365,0.06674485,0.19190295,0.51145643,0.6854338,-0.116538286,0.3015005,0.6512991,-0.1879834,0.80321825,0.72821957,-0.14585006,0.21449637,0.3756334,0.99995553,-0.68411165,0.41636643,0.087818585,0.6542083,0.17110853,0.18956515,-0.495665,0.2968549,0.56911486,-0.52327174,-0.78980315,0.08717062],
    [64,0,"CCN=c1[nH]c(SC)nc(=NC(C)C)[nH]1",0.02769067,0.32123184,0.037437342,-0.20925556,0.12884095,0.30007586,0.31196946,-0.13696288,-0.43827313,0.07853379,-0.028105011,-0.60864645,-0.16119567,0.4302007,0.41929352,-0.73948175,-0.65972376,-0.27972728,-0.7576008,0.36350432,0.4926659,-0.39852497,0.30958036,0.23329698,-0.64542675,-0.033903837,0.07370987,0.52016634,0.1902236,0.045308337,-0.36773148,0.30918548,-0.8388801,-0.7011185,0.30481544,0.6309471,0.32129586,-0.61098105,0.9450282,-0.560489,-0.832148,0.45735812,0.6286368,0.043998085,0.6881634,-0.97490156,0.72162443,0.7802009,0.6168437,0.7064811,-0.22221638,-0.39977446,0.026883425,-0.17893241,-0.34285536,0.20476727,-0.61403793,0.6494604,-0.70829856,-0.18382804,-0.14564848,-0.32332313,0.30119616,-0.4934716,-0.55199665,-0.0909862,0.2376487,0.22614996,0.2594532,-0.07616818,-0.90083504,-0.9989259,0.7827997,-0.14758478,-0.41144848,-0.6549686,0.13474952,-0.5878607,0.77760136,-0.9994927,-0.5613023,0.032291107,-0.88435286,-0.25864238,-0.28075743,0.7784967,0.42524415,0.39189783,0.46671513,0.106885776,0.4234414,-0.6069575,0.20014693,-0.131036,0.99732226,0.5513992,-0.8426247,0.03830852,-0.08243067,0.76634353,0.10322501,0.85789394,0.58498746,-0.43267274,-0.38894013,-0.87051266,0.49572733,-0.06711912,-0.99966604,-0.3403887,0.5591412,0.28499737,-0.31992894,-0.004110718,-0.2540397,0.34640396,-0.6401526,0.48664173,0.9996405,-0.3155988,-0.43844366,-0.2618226,0.69408095,0.051087372,0.7204004,0.016708367,-0.4680032,0.09885267,0.56026685,0.9610616,-0.15971068,-0.40445644,-0.25473174,0.062849924,0.69980925,-0.927668,-0.7256059,0.3986613,-0.7645197,-0.35666272,-0.9983517,0.3436191,0.88712007,-0.5019929,-0.27916265,-0.61902887,-0.5139463,0.25955155,0.7487026,0.30777562,0.22283645,-0.72848135,-0.5743743,0.025203286,0.13296214,-0.6973001,0.020657035,0.9879897,0.30107674,0.3745192,-0.98659813,0.2211192,0.27821478,0.69015193,-0.07347079,-0.546665,-0.001638247,-0.60685885,0.3786743,-0.70855033,0.009630977,0.019628167,0.65432215,-0.061931416,-0.20041984,0.1220631,-0.63175285,-0.2809278,-0.21314825,0.049718626,0.3334177,-0.7479773,-0.55115026,0.025693106,-0.23592609,-0.32947835,0.044643145,0.302824,-0.12928782,0.577973,0.8344095,0.5844129,0.26416886,0.6989652,-0.32755947,0.03826301,0.46391508,0.18507713,0.008111166,0.10390954,0.13682215,0.013891766,-0.587229,-0.001770919,-0.9062559,0.050353333,-0.609213,-0.16642223,0.41661206,-0.9977801,-0.055447824,0.23231024,-0.53170186,0.9495182,0.5817843,0.048335608,-0.43076465,-0.12732808,-0.04712198,0.65374535,0.78635794,0.42465055,-0.16324325,0.33807266,-0.9707198,-0.34186068,-0.21172333,0.31958908,-0.6005034,-0.1480384,-0.003828786,-0.3889593,0.13311245,0.09869158,-0.04868571,-0.68577725,0.07117016,-0.2693086,-0.58655417,0.3488279,-0.9978083,0.01141567,0.190241,-0.10237992,-0.56607276,0.018007867,-0.14438336,0.62753534,-0.5251254,-0.024464542,0.6962107,-0.997975,-0.6065516,-0.7241969,0.65743035,-0.7166949,-0.38470152,0.28942293,-0.309531,-0.45279408,0.03761242,-0.020358734,-0.5407896,0.25556278,-0.05926393,-0.25468886,-0.1615635,0.21743552,-0.35210705,-0.7293313,-0.5294707,0.9991532,-0.016622838,0.7694415,0.2626352,-0.93148804,0.24990672,0.7430196,0.50310117,-0.4093239,-0.034506764,0.9995642,-0.19115198,-0.7708595,0.24196173,0.3403059,-0.5903166,-0.8781579,-0.885586,0.07887102,0.013827038,0.9985858,0.33329108,0.95339906,0.36582524,-0.62119865,0.99953175,-0.51949495,0.8010972,0.492366,0.3963125,0.11979349,0.1263659,-0.30997738,0.7887078,0.8037315,0.8955553,0.7556611,-0.53300315,-0.02559835,-0.7957906,0.81335586,0.23782015,-0.5333825,0.5374344,-0.45010507,-0.402704,0.65643704,0.9440234,-0.3140224,0.5566949,-0.28391382,0.80961347,0.36755246,-0.54763997,0.20658645,-0.6941307,-0.21040255,0.13478881,-0.03217758,0.85149664,0.18519895,0.15888728,-0.10885122,-0.30531576,-0.8881784,0.41285154,-0.11538591,-0.7523002,-0.17448838,0.09178592,0.21104534,-0.1408619,-0.21096931,0.84085286,0.6110333,0.6020822,0.18244763,0.3974994,0.64282316,-0.97994494,-0.7257902,0.14151113,-0.11699713,-0.4495134,0.46079382,0.057649847,0.9993306,-0.21890424,0.013801488,0.41597354,-0.371806,-0.23191662,-0.018514907,0.1498497,-0.012787636,0.34317926,0.5967009,-0.5362841,0.73298204,-0.84322727,-0.242288,0.43594912,-0.69173384,-0.07384042,1,-0.5655765,0.7497978,-0.28801885,0.9117765,-0.71242046,0.17120655,-0.7652855,0.8112244,-0.21668887,0.10215035,-0.814036,-0.21357638,0.18892668,0.728261,0.014429127,-0.020465314,-0.4940741,-0.7251974,0.5387135,-0.8672306,-0.05037846,-0.3179509,0.8932992,0.5118662,0.2312569,-0.107179925,-0.28856844,0.7103759,-0.7666474,0.14763041,0.18019198,-0.39990762,0.4414844,-0.29095542,0.4250627,-0.2840155,-0.5735887,0.68816715,-0.124905616,0.17145486,0.95708066,0.6627049,-0.9780173,0.15054627,0.9994287,-0.50459373,-0.17503104,-0.9590727,0.5937232,0.49153233,0.55402136,-0.5638243,0.37943214,0.2948864,0.31423983,0.6685934,-0.10726747,-0.4716797,-0.70083076,0.30028355,-0.089369245,0.77345777,-0.9999884,-0.996363,-0.9871029,-0.07899553,0.461447,-0.3821437,-0.62029773,-0.5539363,-0.7607157,0.60463,0.8006582,-0.0663607,0.42587212,0.466412,0.17746171,0.67217714,0.8591596,0.22218333,0.40956548,-0.9033084,-0.9999713,-0.29635397,0.00919973,-0.37644148,-0.5249374,0.49313644,-0.43555078,-0.21731955,0.5360562,-0.045625784,-0.22957987,0.15134338,-0.42200768,0.9414579,0.5328152,0.3175994,0.32607123,-0.016766185,0.38508826,-0.39575204,0.17338376,0.32539138,-0.20115083,0.7035388,-0.9640504,-0.44855845,0.27534807,-0.08189505,0.39602506,0.19872291,0.27571538,0.7065206,0.26460814,0.28439876,0.6425335,0.35912102,-0.18430053,0.8005931,-0.53375226,0.69045466,-0.12099108,0.9996663,-0.30085206,0.017846165,0.4081157,0.2262875,0.098526925,0.05199122,-0.96721315,0.12385358,-0.20106228,-0.6160968,-0.5087279,0.14095551],
    [65,1,"CCCCCCc1ccc(O)cc1O",-0.59217286,0.07181558,0.32366934,0.40055802,0.46438354,-0.27731588,-0.57783324,-0.080446646,0.019527245,-0.06217042,-0.80550337,-0.33095667,0.24890937,-0.82423794,0.4947978,0.50391126,0.42217362,-0.50845665,0.572176,-0.34957954,0.18485409,-0.85666,0.2590243,0.6134584,-0.32156613,-0.107561246,0.43330464,-0.17322242,0.43606055,-0.43914533,-0.16563582,0.5475464,0.44068742,-0.17797603,-0.22500756,-0.5229755,0.37498763,0.5554029,0.38221306,-0.9302666,-0.9690035,-0.003927246,0.019057076,-0.2945075,0.3621802,-0.9908637,-0.000461782,-0.18482561,0.8817846,0.25430217,0.67460966,0.08216072,0.5442961,0.28337356,-0.858535,-0.25273487,0.64731115,0.9712279,0.49829435,-0.024778966,-0.20712255,-0.35731295,-0.22333418,-0.19086818,0.261245,0.36312577,-0.5939706,0.17533065,0.36922708,-0.13365409,0.4168605,-0.90732735,0.013014945,0.06353893,0.751472,0.4916861,-0.2510084,0.22827819,0.003833487,-0.9969642,-0.93800694,0.23145646,-0.94039565,-0.14584023,0.057136193,-0.5109443,-0.07448497,0.16650979,0.26769584,-0.6508786,-0.22924861,0.19188276,0.42870688,0.059158657,0.81425506,-0.5297272,0.5991105,0.11702215,0.18381505,-0.17275253,0.3289315,-0.002431082,0.3655907,0.42001796,0.81797063,0.3317892,0.4276071,-0.1621065,-0.9995467,0.12032606,0.34850228,-0.38546532,0.25502172,-0.020918122,0.24769002,0.5240179,0.18525054,-0.16248785,0.9980463,0.35072392,-0.016529594,-0.15012896,0.18802562,-0.4377882,-0.6138913,0.23281942,-0.18449946,0.18154195,-0.13044699,0.99983436,-0.02793866,0.46412417,-0.34484127,0.01324113,-0.5558514,0.30628714,0.17959082,0.8369739,-0.7198743,-0.03787109,-0.9924185,0.2417155,0.99265313,0.08192758,-0.07490718,0.09544992,0.06507274,-0.5568125,0.97401285,0.43093887,-0.22208089,-0.85897934,0.6408566,0.5648942,0.1987073,0.10946141,-0.20638813,0.9967366,-0.46992177,-0.55465,-0.98908204,0.08755184,0.25514582,0.6175764,0.5017821,0.29313415,-0.0422936,-0.11850962,-0.14219812,-0.18953742,-0.14431989,-0.21041843,0.18083349,-0.26937124,0.32870883,-0.98016965,-0.6860178,0.48679534,-0.6931792,-0.17367913,0.18561246,-0.03150377,0.49617884,0.36474797,-0.7935076,-0.15805772,-0.32969382,0.34554827,-0.6091443,0.28224757,0.35102695,0.39090723,0.27569503,0.40364933,-0.011993249,-0.3639807,0.53843707,0.29470167,0.27981701,0.14907081,-0.45640704,-0.46695173,0.2738392,0.48846653,0.3496382,-0.42206353,0.31312448,-0.5475923,-0.004301044,-0.9835545,-0.41079694,-0.008477515,0.1430368,-0.68654346,0.29181135,-0.08344275,0.028054798,0.5638706,0.26283675,-0.17274888,-0.27567235,0.12930983,-0.34695676,-0.5321929,0.99999356,0.47223166,-0.23093627,0.4683814,-0.3501635,-0.5239272,0.14251363,-0.35231835,0.42735952,0.11356912,-0.2613663,-0.13643485,-0.052036375,-0.5334651,0.35471338,0.26106974,0.8981428,-0.15285502,-0.13752042,-0.4327405,0.054922327,0.27563056,0.048013013,0.56382054,-0.21608976,-0.21149229,-0.2824931,-0.99819016,-0.33162272,0.6788885,-0.20307158,-0.34761214,-0.3672146,-0.4254878,0.42537048,-0.01010766,-0.5439878,0.20004287,-0.69390863,-0.55215484,0.61185485,0.16564,0.28713638,-0.5636858,-0.93976265,0.2076107,-0.25616214,0.5210905,0.010711267,0.059227552,-0.26301458,-0.30886602,-0.26119637,0.108961046,-0.05450434,0.63324547,0.10718121,0.99915594,-0.33403507,0.544406,0.07898784,-0.05263024,0.13195159,-0.4893524,0.1672399,0.47256017,-0.329419,0.9988643,-0.40909296,0.6509434,-0.12709557,0.59915245,0.99608165,-0.985848,-0.008642398,0.15884446,0.2189046,-0.21143137,-0.08074975,0.30969033,0.046411615,-0.901681,0.9811596,0.485054,-0.14291866,0.059352417,0.70884424,-0.03921199,0.12904513,0.03998471,0.83758795,-0.12346146,0.06399277,-0.39280888,0.88164777,-0.34038982,-0.29903173,0.025221098,-0.0674523,-0.8879695,-0.43100747,-0.52241343,0.41895932,-0.9199691,0.5197234,0.19282071,0.30996355,-0.20629194,0.37470666,-0.38010427,0.15387194,0.6174913,0.41370037,0.017247112,0.6991918,-0.2140227,-0.34698954,0.3842052,0.22164705,0.54268456,0.4434838,0.4102933,-0.49180824,-0.506663,0.071049236,0.9014112,-0.9943399,-0.13907352,-0.6825534,-0.40276113,-0.07998417,0.27156693,0.5445039,0.9995505,-0.27120504,0.4232895,0.11233974,0.38572502,0.47147056,0.18117249,-0.7238736,0.18372798,-0.3196354,-0.53373456,-0.30296594,-0.000515574,0.029748661,-0.4123992,-0.44673923,0.9014345,-0.06483816,1,0.21152891,0.2594991,-0.05078067,0.33362275,-0.7340359,-0.16870655,0.41906282,-0.25264946,0.35184506,-0.71134007,-0.03131823,0.41264865,-0.06755766,0.5976315,0.1182541,0.39436573,-0.5739398,-0.5669097,-0.25243333,-0.61458915,0.07410177,-0.23968516,-0.069032185,-0.050687104,-0.8820734,-0.35924315,-0.59519744,-0.083692506,0.08029233,-0.26961243,-0.70406836,-0.73479766,0.20570229,0.2869977,0.31157532,0.25075245,0.17388773,-0.39259002,0.5943718,-0.6099613,0.94790596,0.3086429,-0.98938686,-0.29184484,0.9989615,-0.60763925,-0.45316222,-0.9736489,-0.30167347,0.061663575,-0.12979591,0.2525279,0.2377488,0.6490935,-0.05508871,-0.7060172,-0.041308276,0.023650356,-0.39336687,-0.103233576,0.05742275,-0.2527691,-0.9998156,-0.9991046,-0.97997403,0.38965085,-0.03167666,0.7589083,-0.25017333,-0.80662376,0.4407088,-0.22672671,-0.11388256,-0.013023357,-0.76296985,-0.6780758,-0.32882196,-0.27843013,0.50021213,0.2920524,0.025654122,-0.96455604,-0.99975544,-0.5994499,-0.6238001,0.38611194,0.3344981,0.003185015,-0.98542047,0.11753429,-0.8489628,-0.40982023,0.11497016,-0.09787908,0.22277078,0.9566794,-0.40881577,-0.44894716,0.68488026,0.719951,0.26086643,-0.920719,0.37175858,-0.38258076,-0.39379567,0.33423746,-0.59762985,0.44806027,-0.008319095,-0.18003285,0.061352104,-0.80365884,0.48521426,0.046700682,-0.7449221,0.0465716,0.004292014,-0.44184133,0.24418995,-0.17640221,0.028653666,0.20178013,0.051840406,0.99992144,0.6249222,0.36899802,-0.2670307,0.7184855,0.096740186,0.065987326,-0.3538771,0.06700368,0.46615615,-0.37532264,0.4604787,-0.34837207],
    [66,1,"CC(C)OC(=O)C(C)(C)Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1",0.8161734,-0.047403593,-0.5140646,-0.11301615,0.29488084,-0.5006024,-0.82931024,-0.030664792,-0.21860838,-0.2134503,-0.15030196,0.28012946,-0.40530342,-0.29987782,0.03849855,-0.40427524,-0.15794328,-0.33538178,-0.4098173,-0.54250795,0.39513725,-0.2045843,-0.090696014,-0.25420105,-0.21898739,0.5100131,-0.12499077,0.1232685,0.43347743,0.6628844,0.2596789,-0.15879034,0.09427194,-0.6779257,0.28860208,0.28231645,-0.46543813,0.7203384,0.9992589,-0.35245445,-0.92389965,0.10975896,-0.32670057,0.45158747,0.08593575,0.075100824,-0.31548476,-0.32998547,0.9850495,-0.5388804,0.6441749,-0.07506134,-0.2925581,0.37955284,-0.5459219,0.13463542,-0.091493934,-0.7451558,0.44003144,-0.39966726,0.10807532,-0.3332106,-0.009063553,0.3360562,-0.43059552,0.023292119,0.7473127,0.5666277,-0.514138,0.089514166,-0.2373929,-0.6850879,-0.21321867,-0.33805636,0.41711268,0.21373287,-0.11389379,-0.30119663,-0.44556996,-0.99986535,0.09316018,-0.092364386,-0.8099993,-0.7303991,0.24577609,-0.9306634,-0.2964379,-0.22168358,-0.7315638,-0.08849551,0.14506209,-0.33450848,-0.028150424,0.38507238,0.9979099,-0.116356835,0.7277264,-0.61416775,0.08382717,0.20196524,0.23075819,0.12249106,0.33377403,0.95453167,-0.9967871,-0.72262144,-0.003836348,0.85367423,0.9773677,0.27794486,0.52428484,-0.51624584,-0.5310701,-0.07301669,0.11839778,0.73822504,0.20417105,0.43401998,0.96633524,0.095703594,0.11679202,0.34115174,0.053787813,0.18034735,0.09204051,-0.32245648,0.39036646,-0.27906445,-0.18761027,0.99984264,-0.23891039,-0.45906532,0.3323671,0.1901513,-0.66155756,-0.97721165,-0.2134133,-0.11683701,-0.54136217,-0.45048147,-0.9998912,0.3925381,0.70530075,0.42051378,-0.44533554,0.3567674,-0.26217225,-0.101646185,-0.96431404,-0.15159617,0.6384072,-0.92589533,0.29120678,0.061931867,-0.17344138,0.04236985,0.52560663,-0.34016004,-0.7450515,-0.9435718,-0.63092,-0.14237241,-0.40897378,0.42596006,-0.6369308,-0.5199025,-0.060010035,0.64773506,-0.20154898,0.08497914,-0.025280075,0.23253322,0.38493252,-0.049853113,0.1357629,-0.9550937,-0.45397493,-0.002625973,0.015450465,0.37291554,0.26931596,-0.9044827,-0.032726787,0.16357268,0.49064633,-0.30422184,0.60759646,0.39951822,0.21251892,-0.56416196,-0.6524785,-0.5660075,-0.6193031,0.5509855,-0.34586474,-0.2959286,-0.24210173,-0.90574443,0.34884584,-0.03742993,0.078895986,-0.6212984,-0.40640017,0.24174763,0.19462411,-0.41855082,0.39448375,-0.09453045,-0.45972195,-0.9998842,-0.53953797,0.07534951,-0.03268425,-0.28215307,0.26249123,0.025476689,0.26401284,-0.37117106,-0.05660002,0.3021231,0.34049988,-0.32451496,-0.26009265,-0.1239638,-0.9628992,0.008958254,0.5416623,0.10417258,0.055974536,0.2941012,0.13663645,-0.10228414,0.23022594,0.27926242,0.32343358,0.016578194,0.32303154,-0.015981255,-0.0586734,0.26551348,0.82207865,0.41455832,0.46669322,-0.63376826,0.32258713,-0.45120242,0.3966041,-0.3594525,0.37646824,0.33287883,0.28213453,-0.96063656,-0.2584465,0.55545735,-0.31776026,-0.13833943,-0.29028323,0.6363508,0.37713256,-0.48115134,0.12405868,-0.09557246,-0.17837597,-0.7289593,0.31396613,0.27463976,0.47740012,0.5910847,0.9553924,-0.08562959,-0.2698714,0.98486495,0.18222481,0.12198365,-0.58796394,-0.22130723,-0.0725234,-0.2459955,-0.11751774,-0.39537984,0.30258098,0.99430037,-0.48690358,-0.3903414,-0.38384935,-0.25314638,0.55626327,0.8835622,0.44184732,-0.2698859,0.24948096,0.75910705,-0.29267412,0.32992634,0.229663,-0.4449148,0.9999484,-0.9882028,0.6247429,0.03819944,-0.16206847,-0.15268452,-0.6140855,-0.25142598,-0.6730982,-0.800119,-0.97801024,0.009868103,0.9187267,0.34473944,-0.6106742,0.21151192,-0.4790997,-0.7795593,-0.061826035,-0.25137505,-0.42556435,0.2113849,-0.99990875,-0.053709026,-0.61546004,-0.22287463,0.56327343,-0.6603027,0.19081452,0.38996914,0.25897676,-0.88123626,0.36256135,0.43557367,0.001852708,-0.07055829,-0.31074455,0.3621114,-0.06706566,0.6912146,0.2305528,0.37730256,-0.0588071,-0.06375706,-0.06536554,-0.3032058,0.18246533,0.42816514,-0.48349833,-0.15124069,-0.3654203,0.48450166,-0.10880573,-0.90307724,-0.8773087,0.42471787,0.031860925,-0.18316528,0.3685764,0.22556952,0.29203424,0.99941736,0.38670436,-0.04134618,-0.18725653,0.5232345,0.059336934,-0.26700476,-0.9331742,0.16892873,-0.28539583,-0.33470318,0.6937884,0.36353573,-0.47374985,0.3196229,0.24432872,0.12390989,0.44484532,0.9835042,0.34150222,-0.45385697,0.28074354,-0.5016266,-0.1335751,-0.3024492,0.046972368,-0.21168248,0.32743436,-0.25914925,0.5953276,0.2977739,0.21649462,0.32297382,0.61052275,-0.3869537,-0.18448722,0.24736463,0.5189458,-0.5634841,-0.58472943,8.6e-05,-0.39575684,-0.15753305,0.66009146,0.46730396,0.5132537,-0.077010274,0.047404073,-0.67286366,-0.78352463,-0.3528381,-0.6902646,0.23352118,-0.37260577,0.17497653,0.14663453,-0.21818362,0.044823136,-0.006626876,0.99999976,-0.13990141,-0.9557523,-0.016142529,0.9996926,-0.3702764,-0.16736533,-0.9999169,0.415462,-0.81769156,0.34505615,-0.5216937,-0.20086369,-0.03688263,0.13878813,-0.5194674,-0.07269072,0.1875955,-0.06558347,-0.35261866,-0.621853,-0.17847656,-0.9999596,0.99775296,0.18618093,-0.003984501,-0.07860023,-0.23903461,-0.114148185,-0.48985294,-0.34770513,0.63215005,-0.7019309,0.5900493,-0.86901534,0.19137155,0.3720118,-0.01301194,0.39559007,0.4224485,0.12252943,0.8564326,-0.9996458,0.46789467,-0.55856264,-0.27401274,0.033267148,-0.008484603,-0.86093706,0.63340306,0.14753869,0.3666385,-0.36510578,0.06871454,0.40789163,0.9786296,-0.24326792,0.37105876,0.0967502,-0.19596902,-0.63867986,0.25575277,-0.40000832,-0.15211317,0.338631,-0.2756354,-0.70872253,-0.36157697,0.20810564,-0.69951826,-0.3141721,-0.33600914,0.18099837,0.75685453,-0.10894929,-0.24321713,0.17175405,0.99723303,0.44686645,-0.5948664,0.59242874,-0.060925208,0.02019235,0.999943,0.69932836,0.3724788,0.14096573,-0.011222772,-0.010460861,-0.33073562,-0.99343896,-0.49781483,0.33277777,0.30748492,0.5561009,-0.21269193],
    [67,1,"CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C(C(=O)CO)CCC12",-0.23098326,0.28910005,-0.39882377,0.25667894,0.047783956,0.7132013,0.16837482,-0.41005567,0.38868892,-0.17827061,-0.25413185,-0.24265786,0.3804735,0.134771,0.09755525,0.43297067,-0.43156433,-0.49629304,0.39679003,0.04965789,-0.2564174,-0.30409327,-0.28637263,-0.51287484,-0.39161754,0.6577957,0.741214,-0.29169413,0.079629846,-0.43172154,-0.36585483,-0.18628363,0.4249755,0.3307947,0.039534815,-0.11068551,0.05697848,-0.34565136,0.99948174,0.2331077,0.39771554,-0.22000863,-0.040198535,-0.057157487,-0.15162727,0.2407923,0.37519732,-0.19020098,0.9488141,-0.4970303,-0.24137343,0.015463432,-0.43948215,0.67627615,-0.6764075,0.46954226,0.053929225,-0.6850712,0.3802662,-0.52965975,-0.18365024,-0.32793978,0.07389085,-0.056398753,0.7055184,0.03910757,-0.19398159,-0.4637052,-0.2981977,0.86850977,-0.55592674,-0.9532703,0.17060554,0.8702766,-0.123524286,0.93531096,-0.5299053,0.023482552,0.72473824,-0.99987364,-0.87517357,0.01664331,-0.22050598,-0.34014714,0.27565905,-0.6593415,0.05190379,0.003340958,-0.2640859,0.21294405,-0.64686143,0.6305809,-0.0822134,0.17713927,0.9983793,-0.57056254,0.29633188,0.17214996,-0.23082742,-0.45054054,-0.09392534,0.30778486,-0.66921765,0.8722687,-0.9992026,0.2562674,-0.42555252,0.5925178,-0.99760115,-9.4e-05,-0.6448098,-0.46929184,-0.20243461,-0.3704129,-0.100504085,0.29276463,0.26482263,-0.3665657,0.9611336,0.19104615,0.7648482,-0.10422349,0.28293443,-0.3336663,0.5318209,-0.5535689,0.22289844,-0.41694042,0.076116346,0.99840295,0.5918151,-0.12889788,0.13861327,-0.006120746,0.13647728,-0.60417664,0.69503635,-0.025788099,-0.17790605,-0.72281224,-0.999989,0.2539422,0.14431292,0.45121962,-0.25055614,-0.33267212,-0.31301084,0.49370095,-0.99385035,0.532706,0.5256638,-0.94659066,0.87485677,0.35125342,0.28310168,-0.47747537,-0.475065,-0.8684349,-0.638092,-0.47840098,-0.691625,0.012347148,0.010297871,0.09292489,0.57508266,0.28564692,-0.40655282,-0.28596506,-0.1595601,0.83508646,-0.43821025,-0.4125088,-0.1760197,-0.44385964,-0.018647159,-0.97813326,0.8162498,0.2569623,0.70181584,-0.37386003,-0.43784842,-0.9667424,0.3387892,0.22295353,0.9156279,0.25348428,-0.6106805,-0.3948148,0.111966245,0.11127648,-0.6933943,-0.32980892,-0.18147042,-0.31153265,-0.037606396,0.018002624,-0.31081006,-0.15292875,-0.42150253,-0.51235014,-0.4770073,0.08908099,0.42865568,-0.5595504,-0.36197415,0.6329896,0.30147874,-0.15760092,0.14051886,-0.99994564,-0.3388481,0.34896424,-0.13605537,-0.49042484,-0.010332514,-0.39363462,-0.11803464,0.7373414,-0.6217536,0.1549578,-0.19772127,0.05483613,-0.64144397,-0.61498237,0.9999726,0.50246394,-0.294501,-0.041471098,0.5305855,0.7425654,0.21122496,-0.51382226,-0.32704002,-0.001511673,-0.64410615,-0.18887378,-0.37729225,-0.11836693,0.10411605,-0.10579101,0.82330203,0.2247122,0.43038628,0.06913399,-0.9255422,0.40210146,-0.4732451,-0.37357166,0.16419919,-0.42926311,-0.59341925,-0.49181122,0.08085922,0.61076075,0.05911187,-0.5981973,0.48238853,-0.07713615,-0.49158,0.5488078,-0.6731503,0.47631106,-0.5391618,-0.58242285,0.20823446,0.4362228,0.4492812,-0.38855252,-0.19678196,0.5879004,-0.20100535,0.999212,0.12261702,-0.5191487,0.24201417,0.69874084,0.67580044,-0.6209584,0.28048152,-0.56110096,-0.003192561,0.9833553,-0.7473637,0.24489892,-0.4661773,0.08575908,0.15296659,0.29629195,-0.96958816,0.071036905,-0.29339254,0.45430088,-0.67142767,0.31241325,0.24104941,0.49660072,0.9999993,-0.9425535,0.87115747,-0.3318641,0.4706512,-0.34449434,-0.12498817,0.0805664,-0.8623923,-0.96913886,-0.9922687,-0.13988736,-0.5048229,0.017399536,0.34095812,-0.3890405,0.29832882,-0.5835103,-0.51997733,0.67921495,-0.50854385,0.40012166,0.80681765,0.5356506,0.08656869,-0.199356,-0.06738264,-0.32897818,-0.43010688,0.32343942,-0.23319487,-0.30697098,-0.3069401,-0.14337489,0.31652626,-0.5098296,0.45901456,0.102866754,-0.021803379,-0.213338,0.19445175,0.034024328,0.7318371,-0.5072556,-0.2389143,0.061999373,0.8843183,-0.37188676,0.20888305,0.59171206,-0.40736485,-0.21732473,-0.085834384,-0.9182676,-0.59535825,-0.032762494,-0.3169225,-0.6530168,0.35168645,0.47638613,0.2955073,0.99933654,-0.2788074,0.6368227,-0.15388057,0.4208213,0.41611373,0.8915745,-0.77098006,-0.25906384,0.6584645,0.80425626,0.6365124,-0.42545608,-0.16834545,-0.686097,0.59325856,-0.42377076,-0.04350955,-0.99997807,0.6722317,0.17091922,0.26021045,-0.42091674,-0.39408872,0.12780252,-0.051580895,0.12821372,-0.048244834,-0.36581153,-0.2753277,-0.60330343,-0.3975988,-0.9184926,0.45875102,0.10227292,-0.3622963,0.264331,-0.32532382,-0.01899171,0.17675072,0.17951694,0.7050625,0.11439815,0.9285106,0.62007755,-0.6902346,-0.058001716,0.42215255,-0.25087404,0.3030482,-0.49835527,-0.2594011,0.2838193,0.13778594,-0.77703154,-0.23715995,-0.061646696,-0.4723664,0.43144932,0.92228466,-0.122281864,-0.77416885,0.2871505,0.9976909,0.34379652,0.15393372,-0.9903605,0.59142685,-0.4247441,-0.50722396,-0.5607067,0.23300749,-0.47136262,-0.084450856,-0.56803626,-0.36562416,-0.014175076,0.69170225,0.6094285,0.11911282,0.17542912,-0.99991643,1,0.30447015,-0.6348363,0.46517643,0.81397444,0.08247254,-0.052769624,0.7816295,0.4228463,-0.4361214,-0.5155858,0.3635415,-0.2753625,0.42911354,0.48689762,0.19179167,-0.33673763,-0.46526542,0.8728701,-0.99943614,-0.7924873,-0.07933126,0.36622727,0.41541675,0.32095557,-0.2195787,0.43846986,-0.6804302,0.1218323,-0.2685499,0.43437022,-0.35363346,0.20629321,-0.031649772,0.7848822,0.322152,0.46551785,0.055373512,0.4282028,0.09160179,0.39424857,-0.10158596,-0.056458093,-0.99190974,-0.022059107,-0.5677483,0.36747736,-0.50722563,0.25227657,0.30714047,-0.93419373,-0.005173078,-0.6887498,-0.41946986,0.99876946,-0.42322633,-0.6469336,-0.550354,-0.13342313,0.45546308,0.9999687,-0.5238167,-0.45769536,0.17330803,-0.35343447,-0.44767895,0.117278874,-0.99952877,0.31467256,0.3654406,0.20745338,0.69984245,-0.1522772],
    [68,1,"CON=C(C1=NOCCO1)c1ccccc1Oc1ncnc(Oc2ccccc2Cl)c1F",0.62987936,-0.04772363,0.011028857,-0.3817781,0.20145449,-0.033117317,0.20343053,-0.34524179,-0.058403566,-0.30654004,0.52934045,0.28532723,0.06922098,-0.3850122,0.26561943,0.39161894,0.2859271,-0.26632833,0.23686582,-0.5495963,0.50544333,0.70861936,-0.39035422,-0.7493375,-0.35810235,-0.039169233,0.55077916,0.08982878,-0.5509023,0.20250362,-0.23760034,-0.80093265,-0.76638645,0.12846412,-0.14973807,-0.6146681,0.31801462,0.45281267,0.9998946,-0.6673399,0.8000994,0.38350794,0.76679826,-0.26697493,-0.77223384,0.9447984,-0.70679146,0.40378404,0.8653307,0.6976516,0.4092494,-0.51544726,0.14614615,0.6956615,0.70923245,0.34745127,-0.54541594,-0.9326214,-0.49664658,0.19481409,-0.009466031,0.49142402,-0.4089817,-0.20233344,-0.7995593,-0.26997897,-0.8105095,-0.3911378,0.19347925,-0.2652079,-0.9026006,-0.8903868,0.47205028,-0.76395744,0.06793487,-0.39795774,-0.7144758,-0.22929911,-0.27257642,-0.9969223,0.9278516,-0.05999292,-0.96690017,0.3321331,-0.32904154,-0.84667146,0.1228555,0.12883055,-0.51535904,0.17054245,-0.10238995,0.16474131,0.7054298,0.71605545,0.9998936,0.07615973,0.3507515,-0.8697999,0.6411561,-0.44508046,0.6846978,-0.5659695,-0.57462513,0.9823302,-0.999902,-0.9929513,0.15439896,-0.32428643,0.86063707,0.71120137,0.44197413,-0.08610272,-0.29626337,-0.29527107,0.26627192,-0.45347086,0.09940536,0.8594934,0.63499427,-0.4248267,0.14536098,-0.41525102,-0.11889269,0.41250733,-0.7141866,-0.16946016,-0.45457596,-0.32338905,-0.2329578,0.9972721,0.5979271,0.045519147,-0.20506911,0.6929718,-0.2651982,-0.9958698,-0.000563847,-0.6120127,0.22054777,-0.26800045,-0.99999714,-0.5295115,-0.34744146,-0.007957704,0.2795125,-0.16334763,-0.57804984,0.4225309,-0.9996961,-0.08326221,0.8021603,-0.8719212,-0.5309597,-0.61482906,0.053247657,0.154823,0.33710748,-0.985833,-0.6126798,-0.95935655,0.35194197,-0.80093753,-0.10507972,0.078039795,-0.25647154,0.6390966,-0.38044265,0.60667706,0.33152884,0.10479246,0.75823456,-0.5414622,-0.08694915,0.26164868,0.5945377,0.56627524,-0.3899802,0.040637385,-0.821324,0.42857507,0.31014547,-0.94345987,-0.85777324,-0.03393491,0.9576806,0.29132107,0.17637652,-0.13441385,0.019864889,-0.21849918,0.7658521,-0.5945596,0.39266244,0.31985793,0.3136434,-0.012415482,-0.20372126,-0.5954535,-0.15796465,0.28901836,0.20059681,-0.3195999,-0.14829062,0.013715627,0.5917397,-0.49531758,0.4983294,-0.7008038,0.84123784,-0.9999485,0.6428735,-0.35976386,-0.84630585,0.85861886,0.07632819,-0.13810578,-0.002223142,-0.656544,-0.1427661,-0.616282,0.17400567,0.1677654,0.7343642,-0.05320579,-0.936977,-0.5441827,0.6120014,0.07746195,0.6776973,0.7109358,0.15457357,0.45967382,-0.23533466,-0.39309648,0.3128525,-0.09400748,-0.08287374,-0.20791557,0.65195376,-0.5442252,0.8912574,-0.11142324,-0.8127743,0.37350225,0.75718695,0.001586831,0.6356193,0.16085492,0.13045065,-0.18164255,0.09405959,0.12168104,-0.58113664,-0.30353203,0.3929208,-0.4822703,-0.012302188,-0.17855299,-0.54675543,-0.3650871,0.008091909,-0.8005298,-0.40796465,0.07202255,-0.41225684,0.004230976,0.06496976,-0.28592452,0.8824212,-0.64790726,0.28126606,0.99998486,-0.04856638,0.018232923,0.43019247,-0.5265139,-0.2855237,0.013533772,0.09456151,0.27254543,-0.4357749,0.8622784,-0.193121,0.33324707,-0.60891503,0.84381014,0.6613706,0.7106913,-0.2215229,-0.54295456,-0.4949926,-0.59759116,0.88006586,-0.04741402,-0.16548204,-0.44017333,0.9999999,-0.9260111,0.35960445,0.652384,0.3874524,-0.40776512,-0.4172881,0.06343472,0.8686588,0.4992611,-0.9995821,-0.48859724,0.6550348,0.13432795,-0.37792847,-0.7376422,-0.2882338,0.04740399,0.2940848,-0.41690552,0.030805826,-0.18525332,-0.99908173,0.5920555,-0.3132385,-0.031953536,-0.8301081,-0.93283087,0.6954345,0.49265456,0.23159894,0.54248166,-0.51599085,-0.5692884,-0.003403978,0.31833595,-0.3156966,-0.3458238,0.3595892,0.27430817,0.38909823,-0.4178875,0.06876515,0.7121715,0.395221,-0.15851848,-0.23087035,0.8015747,0.61984396,-0.047296625,0.40798852,0.079045,-0.003325001,-0.9839655,0.33839545,0.5041285,0.8117884,0.27280942,-0.20312466,-0.34167728,0.4934024,0.99979866,0.3406657,0.35696694,0.34978643,0.44703424,0.22378896,-0.6571573,-0.45656395,0.15013902,-0.29909348,-0.25796434,0.1650415,-0.490808,-0.35878554,0.71722066,0.54532486,-0.96285695,-0.62746555,-0.9999995,0.17218637,0.06883092,0.46109787,0.587417,0.6179775,-0.5184963,-0.29141733,0.80320394,-0.28063482,-0.8216502,0.01311184,0.057886723,-0.42686534,0.46449926,0.3462313,0.03864056,-0.48240906,-0.42729238,0.5719303,-0.2661926,-0.52287525,-0.11346868,-0.002080214,0.2524965,0.9936652,-0.33328632,0.20324059,0.07892079,-0.55046254,-0.74043244,-0.31486353,0.68916947,0.7878186,-0.24707647,-0.7585718,0.39192405,-0.116625845,-0.27519202,0.33397627,-0.44608873,0.999992,-0.13319309,-0.941172,0.1661207,0.98825794,-0.25985983,0.09535688,-0.99969906,0.65052074,-0.8971302,0.3229222,0.23554453,0.21683091,-0.35897678,0.47063714,0.39681187,-0.41444984,0.116186075,0.12667754,-0.09631882,0.40774947,-0.65282404,-0.99923694,1,0.8335583,-0.007999737,0.73341715,-0.7235731,0.40678,0.20987058,-0.001752993,0.1321351,0.16592018,0.8892086,-0.6223194,0.016551033,-0.85502946,-0.31921858,0.72397476,-0.43373734,-0.7220126,0.9840438,-0.99295104,0.14099655,0.86731267,0.011661567,-0.14557238,0.4257334,0.6354767,0.54225147,0.061506394,0.40526998,0.26229474,-0.08915997,0.72557425,0.9785752,-0.031173123,0.47523555,0.5748448,-0.056951813,-0.03619356,0.3969082,-0.13054717,0.22652875,-0.34545413,0.44351023,-0.99453515,-0.22322132,-0.13836099,0.09639887,-0.13558446,-0.60747504,-0.4905831,0.11881557,-0.23619038,0.638992,0.13582128,0.99980325,-0.016612565,0.6886678,-0.27952853,-0.000532454,-0.4492076,0.99956506,-0.18133286,0.2481777,-0.20224455,0.16464314,-0.6935548,0.56039697,-0.9996033,0.8431914,-0.26408032,-0.32186225,-0.83496565,-0.35885328],
    [69,1,"CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C",0.98846495,-0.19267279,0.17632371,0.16678244,0.26442915,-0.09924043,0.10060821,-0.5796921,-0.0905896,-0.16225141,-0.41621706,-0.6016909,0.3650297,0.56122106,-0.76004153,-0.43959308,0.07845958,-0.23616531,0.41828611,0.3001492,0.082710944,-0.50198805,0.2964888,0.17242473,-0.31715864,0.4986105,0.09921219,-0.50645536,0.036179963,0.7328792,0.4271956,-0.24114445,0.18365219,-0.08719111,0.7722535,0.5378467,-0.1789836,0.46168944,0.9937716,-0.31169465,-0.97897035,-0.6441274,0.5741496,-0.014236655,-0.10155865,-0.82023144,-0.17868645,-0.7016766,0.9988337,-0.047091242,-0.17103192,-0.046393413,-0.5702143,-0.013346385,-0.33314475,-0.3616136,0.28013766,0.26470375,0.41574383,0.54889363,0.23074742,-0.087630615,0.6119976,-0.6187082,0.13024606,0.62356365,0.5702197,-0.35280302,0.4237321,-0.3627203,0.55433106,-0.9340106,0.15365022,0.19835413,0.43005517,0.16824302,-0.86864775,-0.31621113,0.03566696,-0.9999612,0.010642952,-0.15686938,-0.83671534,-0.3235217,0.08802642,-0.5184043,-0.15078531,-0.18332465,-0.5456985,0.7701813,0.10128211,-0.50547343,0.4346614,0.3900971,0.998378,-0.12752987,-0.15541315,0.30109978,-0.05893422,0.3107012,0.458662,0.33857623,-0.46401593,0.381968,-0.92365986,-0.87059474,0.06542865,-0.08669559,0.9967537,0.53637034,-0.080944926,-0.46245632,-0.49854016,-0.45487788,0.4374739,0.41799402,-0.16220884,0.44446003,0.99625486,-0.44872418,0.6085469,-0.30405116,-0.08754593,0.107905194,-0.18317139,-0.25207782,-0.105166785,-0.71389306,0.32957244,0.99932534,0.210119,-0.08025988,0.36422867,0.22020422,-0.48494044,-0.96762335,0.017846161,-0.18996763,-0.59310424,-0.048719686,-0.9837705,0.5593651,0.8305798,0.4418499,-0.55223465,0.71696454,0.020128833,-0.58174074,-0.35289162,-0.26512992,-0.6498214,-0.9487103,0.2357382,0.56808144,-0.2803278,-0.24289656,-0.4733944,0.8494465,-0.8076492,-0.9578113,-0.89712405,0.06850377,0.012189457,0.51981443,-0.22889006,-0.5231718,0.171866,0.8367601,-0.36091864,0.5955006,-0.002258967,-0.1920836,0.6769895,-0.637066,0.08564338,-0.97184336,-0.19616657,0.30337384,-0.40988597,0.09897197,0.531456,-0.98904556,0.20398127,-0.093530186,-0.39497742,-0.53679293,0.34426504,0.350614,0.3065521,-0.52848643,-0.2895187,-0.49320415,-0.23838931,0.6865302,-0.030481217,0.48303187,0.29320952,-0.86951524,0.32978907,0.5482577,0.28553626,-0.34614253,0.25370023,0.26902637,0.17320956,-0.101176396,0.68410885,0.30279452,0.05708061,-0.9999143,-0.3920693,0.052202288,-0.32626346,-0.16086656,-0.046838194,-0.001405823,-0.27999613,0.35219458,0.42971745,-0.69315434,0.16963595,0.3019164,-0.2545958,-0.763921,-0.9923812,-0.08030647,-0.06381783,-0.8306296,-0.3435281,0.5279164,-0.6613681,0.79788464,0.16041414,-0.34100774,0.22350286,-0.053136285,-0.5442327,0.093710184,0.044375308,0.34990895,0.93651944,0.21285023,0.45226884,-0.7052536,-0.047991116,-0.749749,-0.27219003,0.46680322,-0.35449913,0.08024896,0.41994122,-0.9978371,-0.2546234,0.64470136,0.32621726,-0.61319786,-0.26097667,0.51841974,0.33644563,-0.5846751,0.15286036,-0.35098535,0.41936347,-0.45971313,-0.5516333,0.7761192,0.105031475,-0.14723851,0.91843575,-0.002097589,0.32722446,0.74112463,-0.28386998,-0.2307835,-0.023005348,-0.7326518,0.3625342,-0.44452012,-0.2688852,-0.0689319,0.5646213,0.9981862,0.06550196,-0.37437356,0.03621762,0.63135016,-0.16631009,0.6035655,0.77174217,-0.59288174,0.67738694,0.98825896,-0.32702586,0.89999,0.37720916,-0.19811489,0.9934533,-0.966319,0.26401532,-0.33945793,-0.010237105,0.53221005,-0.3395171,-0.24435452,-0.5007812,-0.56975335,-0.3864632,-0.6114805,0.42104462,0.6619089,-0.13894746,-0.32680777,0.19316114,-0.3353433,-0.42947942,-0.33661732,-0.3107898,-0.6786254,-0.99997824,-0.3643871,-0.58884406,0.47919255,0.198106,-0.5475622,0.31804657,0.17701265,-0.033436954,-0.8685234,0.5909744,-0.27387443,-0.17631517,0.7148682,0.24899869,-0.31062725,0.19164035,0.13322768,0.40562117,0.3204731,-0.054434367,-0.30930725,-0.23154838,0.5801007,-0.4818445,0.7620522,0.06514246,-0.06599361,0.10456155,0.18971027,-0.38538092,-0.26966235,-0.962991,0.8605121,0.068319656,-0.35036027,0.7470906,-0.41506374,0.6679878,0.99914014,0.2069972,-0.20638849,0.33712807,0.11061448,0.0371185,-0.6144262,-0.5957313,0.63942397,-0.41695827,-0.30677247,0.25534314,-0.16209114,-0.4278097,0.18345287,-0.006386681,0.52489316,-0.069565594,1,-0.42912772,0.4051591,-0.4324641,-0.56959516,-0.6443252,-0.18160939,-0.35078657,-0.16535348,0.27278715,-0.29292127,0.2962785,-0.0312229,0.014699881,0.4839435,0.43459475,0.16086164,-0.30523634,0.4751716,0.18279956,-0.9179468,-0.20747095,-0.2738214,-0.082117125,0.08458099,0.37396538,0.13136643,0.15323989,0.21538655,-0.24533562,-0.525507,-0.15722008,0.17695144,-0.15774214,-0.49648863,-0.63928175,0.1789104,0.015632674,0.28405762,-0.29032725,-0.56861246,0.99999994,-0.44287768,-0.9852409,-0.25947556,0.9995272,-0.8908639,0.5352177,-0.99993074,-0.09526385,-0.7820966,0.22977895,-0.40256095,-0.08979842,0.20105071,0.5133003,-0.22582403,0.49558946,0.84392637,-0.5100189,0.12501916,0.42387596,-0.82819545,-0.99991834,-0.99682605,-0.8756316,0.116210744,0.2512167,-0.09592023,0.38607398,-0.43542367,-0.20998167,-0.34257957,-0.764035,0.24547637,-0.71015704,-0.12771349,-0.15943354,-0.17772686,0.6406106,0.17274903,-0.4857536,-0.3739044,-0.9998052,0.25689682,-0.3568187,-0.24160068,-0.52801526,0.08995173,-0.7790953,0.7165056,0.6537595,-0.23534825,0.06883542,0.6703029,0.062793136,0.92287904,0.2913177,-0.09575413,0.48448882,-0.27208096,0.2050563,-0.012391483,0.63267374,0.74983406,-0.27366802,0.1809072,-0.88702935,0.48735017,0.30643028,-0.32981288,0.19794063,-0.36335167,0.13427769,0.53955215,-0.3055931,0.48033422,-0.044396296,0.97763723,0.15037724,-0.29884154,0.048237555,0.52365977,-0.2418892,0.9999432,0.4387628,-0.78409946,-0.025354031,-0.24116367,0.19837928,-0.17180297,-0.9877786,-0.5059601,0.001406391,-0.41608748,0.22569908,0.09583843],
    [70,1,"CCCCCCCCCCCCN1CCCC1=O",-0.45087367,0.351688,0.12756194,0.21022978,-0.36054808,-0.14521165,-0.278189,0.14956431,0.53510046,0.42439705,-0.74629164,-0.31759483,0.14255446,-0.58527863,0.46499723,0.6894793,0.5986232,-0.5739364,0.17320412,-0.5726503,-0.023728577,-0.6103166,-0.54934543,0.261141,0.76259714,0.34445646,-0.36275697,-0.38460296,0.29862794,-0.6475074,0.013668165,0.56778127,0.68185824,-0.3502011,-0.11960842,-0.4821027,0.6333564,0.54891396,0.87797976,-0.722403,-0.9900075,-0.36218676,-0.45267418,0.50478715,-0.4363399,-0.9690555,0.49730033,-0.595726,0.95691943,-0.04624452,0.66258776,0.34184197,0.09747882,-0.554064,-0.80477715,0.017486978,0.9270427,0.9234154,-0.24729194,-0.14256096,-0.048359115,0.3477377,-0.64917904,0.6002251,-0.2729362,0.5123199,-0.63607156,0.17702478,0.6822348,-0.07033377,0.009863395,-0.5286475,-0.31933004,0.8232315,0.7720179,0.22370133,0.11135162,0.07449279,0.3817079,-0.9998937,0.007627719,0.4693105,-0.5288382,0.0654858,0.690607,-0.89009607,-0.41343132,0.60469633,0.044606164,-0.14316769,-0.4860263,0.12698041,0.41892236,0.30507293,0.9700124,-0.7063688,0.76231617,0.18785986,-0.36856735,-0.3460713,0.17284063,-0.05431831,0.2917406,0.97589105,-0.0730237,0.7919971,0.17805101,0.14808097,0.9776709,0.19035527,0.12573308,0.48011017,0.6388455,-0.16791913,-0.02929816,0.09000146,-0.16111693,0.2090098,0.9938581,0.5927082,0.017330643,0.26985502,0.14083835,-0.24607398,-0.5659512,-0.25992918,0.23588555,0.30413172,0.43554065,0.99995095,0.2167359,0.67426574,-0.5189313,-0.46306095,-0.035299547,-0.9549717,-0.41064352,0.27381444,0.21129861,-0.6874929,-0.9846691,0.24872938,0.98194337,0.74840194,-0.49333835,0.22129908,0.5956995,0.17922442,0.8384688,0.23345236,-0.6342912,-0.7195972,0.61278856,0.42171493,-0.067742,0.4538962,0.07323204,0.9814156,0.40787452,-0.90677476,-0.93731165,-0.66942513,0.49701664,0.10319187,0.4845318,-0.5428806,-0.6523557,-0.42090952,-0.028444685,0.18680538,0.46015972,0.32980305,-0.66802067,-0.31883764,-0.2838475,-0.98415136,0.6232156,0.6328087,-0.10510462,0.11461772,0.20688939,0.13732648,0.36183733,0.5074021,-0.883982,0.10011064,0.15237352,0.436135,-0.7283913,0.92366815,-0.934844,0.11314183,-0.39191926,0.7360846,0.17702232,0.01666321,0.047821745,-0.85217017,0.6931635,0.67811847,-0.026629908,-0.28692836,-5.63e-05,0.019009225,0.050729185,0.22823554,-0.38881558,-0.65815645,-0.19530967,-0.9983219,0.061370198,0.75784564,-0.2570175,-0.8864225,0.4646592,0.06989957,-0.0941737,0.05816278,0.31135538,0.51655024,0.110354856,0.033185393,-0.75351715,-0.09328211,-0.927191,0.65931857,0.40743127,0.12854561,-0.2607766,-0.36122084,-0.40303835,0.3779049,0.12239766,-0.10938296,0.37344605,-0.21494915,-0.017015379,-0.76286525,0.08282853,-0.11306823,0.8314775,-0.27826396,-0.29631707,0.3740625,-0.83246624,-0.032144465,-0.075559966,-0.10862879,0.17579716,0.5593071,0.35887212,-0.99752754,0.032130014,0.3889469,-0.07812444,0.61409193,-0.4901073,0.43217316,0.21152161,-0.12528467,-0.35596552,0.59287214,-0.71213394,-0.5861746,0.5811017,0.11757697,0.6582413,-0.75179225,0.4696851,-0.46185908,-0.4697064,0.04572886,-0.65921,0.482116,-0.3241217,-0.15170299,0.41753653,-0.64469326,-0.42858106,0.64530253,-0.2656986,0.99898297,-0.83784944,0.5482752,-0.6082257,0.32813725,0.83791685,0.9560507,0.95151,0.60609573,-0.47373554,0.996768,0.15400454,-0.6896875,-0.041140635,0.64604694,0.99782336,-0.99738294,-0.3568165,-0.012996574,0.11692113,-0.58753526,0.4200678,0.29688936,-0.4750941,-0.8689877,0.5390828,0.6113655,0.46783638,0.21923928,-0.47898358,0.4458224,0.15567626,0.29453683,0.8437436,0.36513668,0.556669,-0.31948873,-0.99995565,-0.16926089,-0.45797935,0.45726126,0.46759823,-0.72361296,0.39747006,-0.43806306,0.10660321,-0.9405308,0.009470617,0.1764955,0.13798651,0.19122824,-0.22565015,-0.79806614,-0.50294715,0.9121891,-0.4666819,0.44208106,0.8396076,-0.016317712,-0.024629585,-0.30799478,0.38618618,0.7015611,0.31457362,-0.24093722,-0.15303919,0.5311456,-0.4281772,0.6453772,-0.9941119,0.7297088,-0.25233567,-0.29989696,-0.04450514,0.5638722,-0.27260166,0.9994602,-0.54460096,-0.3803599,-0.5638468,-0.5875733,0.21782143,-0.07242021,-0.24194412,0.082712114,-0.2898104,-0.82006675,-0.7036897,-0.23485039,-0.21522038,-0.5942575,-0.9398243,0.67669874,-0.61229056,1,-0.40409535,0.039048184,0.13921963,-0.20440684,0.26646787,-0.30167744,0.93468416,0.2919854,0.24833524,-0.55239487,0.43839228,-0.11962211,-0.60041326,-0.78784233,-0.3773755,-0.40496132,-0.27583006,-0.39460197,-0.3802246,-0.9435829,0.47773233,-0.63153034,-0.9225116,-0.5376619,-0.74895203,-0.17823043,-0.43085456,-0.033034828,-0.11227158,-0.5690796,-0.3375694,-0.63184834,0.03066634,0.36860058,0.517043,-0.7698787,-0.10853926,-0.07675589,-0.2041518,0.14232576,0.9999999,0.30805898,-0.80138165,0.14135872,0.99719805,0.2971959,0.016302325,-0.99995726,-0.24910186,-0.79239535,-0.5755172,-0.023540718,0.27348104,0.44057706,0.4765929,-0.8151843,0.49096915,-0.5123681,0.03221217,-0.15643923,-0.31768197,-0.46413067,-0.99982655,-0.99783754,-0.8083765,0.23271777,-0.053527705,0.6139041,0.008217718,-0.046088886,0.9347116,0.13737436,0.18456018,-0.18347973,0.36361217,-0.2917346,0.051721144,0.23053312,-0.2611415,-0.5142824,0.10828203,-0.81125504,-0.99947923,-0.6606849,-0.67062473,0.5935532,0.47066846,-0.19166504,-0.99458015,-0.3718744,-0.022897128,-0.53589153,-0.5449775,0.6965954,0.09001401,0.2944448,-0.3008659,-0.8850983,0.7039501,0.39454424,0.34450194,-0.5827217,0.3242168,-0.46292445,-0.09014946,-0.46332526,-0.7539509,0.75978047,0.3556483,0.47416514,-0.24993646,-0.32170662,0.28190246,-0.96166354,0.023027783,0.43061456,-0.49457675,0.7377778,0.41850266,-0.4119562,-0.18685336,-0.25966066,-0.14346439,0.99995446,0.72023827,-0.08226821,0.52159005,0.4190991,-0.34418628,-0.18982108,-0.95075,0.45198074,0.6237493,-0.13452025,0.6946377,0.32447484],
    [71,1,"CCOc1cccc(-n2cc(C(=O)N3CCN(c4cc(C(=O)O)c5ccccc5c4)CC3)nc2-c2ccc(C)cc2)c1",-0.7699635,-0.5813959,-0.566681,0.17344552,0.20631248,-0.04462003,0.77337617,0.00124718,-0.37437657,0.5892535,-0.28833953,-0.104190074,-0.6513374,-0.64956987,0.26358357,0.23441918,0.1287944,0.37323818,0.20839345,0.37775737,0.25786197,0.63685864,0.16668928,0.104795426,0.20910761,0.5827573,-0.20098281,0.4802681,-0.35223022,-0.22186169,-0.39470434,-0.6406197,0.38143674,0.056752842,-0.5546192,-0.40376014,-0.16883081,0.5455349,0.99983644,-0.3233959,0.14444716,-0.48325208,-0.3196247,-0.3620996,0.35290352,0.9988071,-0.3731529,0.76260775,0.11699217,0.22563353,-0.06833404,0.35620153,0.081346095,-0.47392455,0.6327925,-0.25131777,-0.35785046,-0.9979154,0.06658547,-0.41848928,0.31683877,-0.4109288,0.565067,0.33286154,0.10308899,0.532602,-0.41553083,0.3820706,-0.42053542,0.30077246,-0.9896989,0.75306845,0.1668753,-0.8826001,0.740625,-0.5787257,-0.52512306,0.057713397,-0.22722578,-0.9970648,0.37309468,-0.29153797,-0.97485656,0.10152887,-0.09884183,-0.9924337,-0.004382737,-0.5174768,-0.008331519,-0.21696812,-0.050375648,-0.037977375,-0.35750788,-0.40915182,0.99890894,-0.26456934,0.41996711,-0.81576943,-0.033485204,0.07862366,-0.3642344,0.04252755,0.40436494,0.97995955,-0.9999671,-0.65527725,-0.61361307,-0.025638888,-0.8288369,0.06268094,-0.5613805,0.61075556,-0.23326252,-0.015071058,0.23814026,0.17888357,-0.60242975,0.39572725,-0.9913931,0.5073617,-0.523518,0.7720393,-0.2108505,0.680051,-0.28140986,0.29983917,0.053406406,0.104193516,-0.36762178,0.9998886,-0.6606503,0.6236954,0.11483102,-0.6356049,-0.35369635,-0.9627101,0.28439376,-0.21872768,0.18143137,-0.6481049,-1,-0.10189467,-0.87093025,-0.07029731,0.07095824,0.598593,-0.40240243,0.13801968,-0.99999267,-0.36873397,-0.53470045,0.37071255,0.27357024,0.092718266,-0.26642656,0.6531473,-0.41381332,-0.9999635,-0.80209595,-0.82389504,0.99543756,0.41769475,-0.23422776,0.37643933,0.3434454,-0.2428687,-0.52586186,-0.043192532,-0.3957725,-0.1435042,-0.020771688,0.2865885,0.7058336,-0.35735872,0.010159726,-0.49722135,-0.18354604,-0.45336872,-0.5236229,-0.2788685,0.2521549,-0.7738811,0.34415212,-0.040841386,0.93138266,-0.43544134,-0.5412962,-0.25230575,0.4432085,0.634617,-0.5759244,0.6371668,-0.23294705,-0.37541178,-0.6572124,0.3875893,-0.26777652,-0.8131356,0.37192914,0.4059731,-0.5193052,-0.25679478,0.4246442,0.22314318,0.21037416,0.15711965,-0.5624629,-0.6564766,-0.4682992,-0.99974376,-0.28963304,-0.6136777,0.27685773,0.54421145,0.4810023,-0.039190646,0.023604685,-0.28815663,0.51352125,-0.7320787,0.15523854,0.2144176,-0.6042292,-0.47838643,0.9892146,-0.43199772,-0.5473105,-0.026428329,-0.18579169,-0.7885573,-0.18548782,0.68336314,0.69244885,-0.2575601,0.42887866,-0.5135883,-0.37479118,0.27806893,0.10905717,0.17995152,0.9118711,-0.5542253,0.39955541,-0.7355514,0.78083694,-0.7503543,-0.2181356,0.3631146,-0.07958791,0.37395287,0.41291833,0.86249423,-0.3889084,-0.6321045,0.19336541,0.33720785,-0.19573036,0.65706015,0.13121715,-0.028588684,0.056794394,0.57475334,0.6645853,0.27302814,-0.49539965,0.5658588,0.38380277,0.26964274,0.95139754,0.33912995,0.6954956,0.99683845,-0.06551744,-0.05541572,-0.5759481,-0.50757724,0.08550979,-0.12899931,-0.81972694,0.3899057,-0.092687905,-0.95135224,-0.034840558,-0.584779,0.3794538,-0.103859566,0.14873302,0.9328033,0.06712152,0.018843712,0.24097252,-0.9997173,-0.43019283,-0.22483261,0.14199716,0.28349924,1,-0.98871326,-0.64275444,-0.44755965,-0.22571045,0.5580628,-0.57123023,-0.20473956,0.581837,0.17661865,-0.99999064,0.22931679,0.9746373,-0.056248125,0.17080928,0.10832201,0.5235702,-0.13031255,0.4491223,0.034241974,-0.2523112,-0.12376177,-0.927936,-0.3335105,0.40741852,-0.07067189,0.25297096,-0.8717729,0.113649786,-0.067225225,0.4374443,-0.8829418,-0.5132915,0.76712286,0.14325732,0.36220753,0.10289586,-0.4063068,0.056405082,0.9194445,-0.70670706,0.33560833,-0.44838324,0.15170883,0.54159343,0.7662036,0.7318673,-0.7123018,0.05219936,-0.2664807,0.08077186,0.6429276,0.17338257,-0.99913925,0.990212,0.32578915,-0.80259657,0.056411427,0.34249467,-0.45307028,-0.26279968,0.9981649,-0.57081586,-0.70073736,-0.06767401,-0.47655103,0.19011787,-0.15967034,-0.94281423,0.37994215,0.02947526,-0.3679027,0.22772926,0.08862374,-0.54817736,-0.23444925,0.32914275,-0.8967644,-0.10613134,-1,0.4906651,0.60267884,-0.022443162,-0.25396565,0.92837965,-0.27340037,0.14158364,-0.23104903,-0.55607253,0.87580997,-0.09294257,-0.29596236,0.091467254,-0.82456505,0.17896701,-0.6600571,-0.37554112,-0.108711645,-0.10293313,0.8290989,-0.3484966,-0.7834682,-0.619497,-0.35650688,0.99165565,0.6258852,-0.5162574,-0.06849177,0.46064043,-0.42970172,-0.44328833,-0.14456984,-0.36077735,-0.53813446,0.3204258,-0.34544748,0.06648182,0.040461633,-0.26176602,0.41758972,0.9997679,-0.08748844,-0.9327999,0.37913823,0.99911904,-0.4920742,-0.43101415,-0.99846476,-0.29410255,-0.9785258,0.14815329,0.251328,0.24794933,0.5526984,0.872826,-0.8672424,-0.31672275,0.42876557,-0.28847134,0.13263568,0.26854062,-0.009016654,-0.66228175,1,0.9987048,0.20920499,-0.13386174,-0.9017225,0.22921373,-0.7276489,-0.3292756,0.03661805,-0.49460733,-0.18631862,-0.35603777,0.5749924,0.4268486,-0.46430627,0.49390015,0.038785603,-0.2275391,0.99984115,0.5273796,0.7035732,0.1792399,0.42839876,0.48454168,-0.449224,-0.37391123,0.5588249,0.117058486,-0.43218002,-0.025572835,-0.14813519,-0.6154297,0.9908285,0.51524305,0.69836164,-0.46879026,0.17964695,-0.5469796,-0.16386043,0.2837105,0.04215943,-0.35737833,-0.51264983,-0.5994406,0.18354735,-0.09619968,-0.17756177,0.4405886,-0.06689024,-0.44750854,0.25452492,0.52970624,-0.52624357,0.06455381,0.9998783,0.112605564,-0.75949955,0.5338602,-0.2476453,0.49723712,0.99957246,0.58856577,0.15083143,0.28193435,-0.25281247,0.024589945,0.075698234,-0.9969351,-0.7391887,-0.076412074,0.13728704,0.3367655,-0.033153176],
    [72,0,"CC(C)=CC1C(C(=O)OCc2coc(Cc3ccccc3)c2)C1(C)C",0.339162,-0.56646407,0.24444015,0.33985907,0.67161447,-0.55941325,-0.39627206,-0.24517345,0.4799274,-0.6676215,0.21428546,-0.46164778,-0.6009952,-0.2301887,0.7671912,-0.47324407,0.49484384,-0.93155235,0.43287027,0.19890012,0.46099442,-0.2173133,0.34356543,-0.27711582,0.052685406,0.2561905,-0.20027816,0.13109574,0.017844364,0.77204645,0.025871098,0.13875571,0.6566769,0.14747633,0.45496732,0.023161337,-0.49817717,0.40864018,0.9993153,-0.2676802,-0.8352993,-0.23760131,0.1702905,-0.69676846,-0.8976772,0.07324525,-0.5889328,-0.598495,0.9932274,0.21815807,0.47677878,0.8835973,0.06786046,0.22753213,-0.3465735,-0.33885616,0.17826228,-0.6456067,0.18988456,-0.110269524,0.5877622,-0.69305855,0.47485635,0.71588874,-0.3562147,-0.20324615,0.85727257,-0.4174482,-0.4462601,0.05071025,-0.18379124,-0.39978743,-0.59650296,-0.031853266,0.83534324,-0.54688656,0.5722772,-0.3336595,-0.04833897,-0.99985456,-0.08500403,-0.6970526,-0.9571417,0.3517117,0.2332036,-0.9597309,-0.6245627,-0.59398615,0.29597136,0.21223915,-0.15444694,-0.2882693,0.43271065,0.18019818,0.98856884,0.41165608,0.77785754,-0.03432571,0.35417077,0.099771105,-0.13300988,0.03101644,-0.50603557,0.989578,-0.99735576,-0.16981067,0.11458004,-0.052648425,0.9710156,-0.6114421,0.10318122,0.4943801,0.6806649,-0.085543096,-0.42986348,-0.10571809,-0.83646667,-0.10552377,0.9504016,-0.018293478,-0.41392308,0.5592056,0.38750514,-0.01815027,-0.20024689,0.06672664,0.22257718,0.23250261,0.22081234,0.9999259,0.59519696,0.34247065,0.38513958,0.36690363,-0.033093516,-0.9924101,0.14557418,0.2963676,0.26982015,0.1685655,-0.999995,-0.15067433,0.82581013,-0.15974565,0.45953873,0.66357785,-0.69314736,0.6719967,-0.979985,0.053501926,-0.41316354,-0.5427,0.7758937,0.5814443,0.09575445,0.07946533,-0.45270303,-0.40528643,-0.83409864,-0.94647396,-0.59291255,0.723426,0.5114597,0.20347962,0.041118316,-0.28385076,0.5165184,0.42734683,-0.0554238,-0.071131274,0.5896747,0.4115907,0.61895597,-0.19878568,-0.031020716,-0.94107646,-0.22542892,-0.195528,0.6082099,0.04751484,-0.029218266,-0.31588703,0.20496517,-0.41235942,0.17428997,-0.4262822,0.6256479,-0.06721221,0.3528666,-0.269025,-0.90611565,-0.12167657,0.62084615,0.446222,-0.009241045,-0.5002334,0.32120356,-0.9188546,0.32656425,0.2112193,0.27504936,-0.681855,0.3353839,0.03174486,-0.38426197,-0.11313785,-0.55975753,-0.51644546,0.8377221,-0.9998903,-0.68867147,-0.48348558,0.2113774,-0.69441223,0.22675927,-0.1899421,0.4816608,-0.6797445,0.6032015,-0.3094663,0.14005752,-0.25013298,-0.09633838,-0.6719349,-0.99012136,0.6521223,0.20823938,0.14697282,0.40806538,-0.20309588,-0.53728485,0.11217886,-0.44982177,0.18071175,-0.27341843,-0.14369127,0.66243285,0.14686541,0.6613255,-0.16987331,0.9339081,0.7476668,-0.5515954,-0.60691994,0.12927827,-0.37956837,0.426708,0.21690503,0.040320437,-0.42569,0.27699327,-0.7491807,0.26876694,0.38214993,0.6928365,-0.03452665,-0.54017454,0.25534165,0.3035546,-0.22519396,-0.7817971,0.10128904,-0.34273928,0.057890587,0.15801042,0.532322,0.5539636,0.16743745,0.96377957,0.36965132,-0.07437702,0.99681604,0.025900772,-0.056132052,-0.7234043,-0.14045203,-0.2910682,-0.79818696,0.25613716,-0.8711034,-0.091843486,0.99593663,0.67458105,0.5083852,0.7196451,0.2127096,0.067354195,0.8957078,0.88349766,-0.37636518,-0.18774985,0.7332578,0.5329306,-0.2471752,-0.72016364,0.36271456,0.9999996,-0.9910234,0.03411089,0.3658981,0.2999004,0.11106138,-0.30691668,-0.6843789,-0.13258643,-0.44874915,-0.9876324,-0.40712166,0.90285546,-0.57374567,0.5540821,-0.45427674,-0.47016096,-0.2354517,0.7765696,-0.6289835,0.6810921,0.47778654,-0.9999421,-0.32474184,-0.75476694,0.62315387,-0.32716122,-0.52291083,-0.24948606,-0.12694433,0.035023615,-0.8466916,0.15657212,0.62303513,-0.52400845,-0.051354837,0.09186231,0.19017684,0.166887,0.809841,-0.037611075,-0.043382164,-0.15834066,0.47834405,0.1802962,0.29414818,0.561734,0.65599954,0.26159316,0.23053342,-0.5393139,-0.55744994,0.1680322,-0.8731216,-0.8989616,0.33604386,-0.6480737,-0.35904703,0.3356805,-0.5691835,0.7287398,0.99960977,0.42777815,-0.08697965,-0.7910809,-0.37577626,-0.3611675,0.5286907,-0.9021035,0.8765735,0.36210325,0.2213281,0.37168616,-0.673748,-0.6271739,-0.25859907,-0.5394165,-0.027818764,-0.015231093,-0.99551374,-0.24995668,-0.06296224,-0.22276112,-0.40573213,-0.4966077,-0.02448675,-0.08087914,-0.25169864,0.17311573,0.21258722,0.24944471,0.7688491,0.4981652,-0.6739405,0.5678738,-0.06879391,-0.4696624,-0.16129217,-0.046123203,-0.003051681,-0.33338326,-0.3610182,-0.7396375,-0.53285867,0.34959856,0.26847604,0.5831517,0.073007785,0.12044355,0.84904724,-0.59559894,-0.3101503,-0.08209728,-0.6620134,-0.07216941,-0.57221967,-0.3995847,-0.34312588,-0.39677075,-0.34274104,0.9999995,0.11137066,-0.9780967,-0.086533025,0.9987036,-0.68002677,0.260753,-0.99990577,0.4496698,-0.9202959,-0.664393,0.036517594,-0.08402785,0.5221838,0.45878386,-0.8460549,-0.5265704,0.3144242,0.69947726,-0.53323877,0.5013005,-0.7368098,-0.9999547,1,0.5107806,0.386948,0.49724695,-0.04278573,0.18008482,-0.22600953,-0.29865152,0.10184988,-0.54378325,0.114068285,-0.7762771,0.08839392,-0.70299536,0.26132405,0.8134762,0.19466814,0.056243487,0.83575606,-0.99966764,0.17386611,-0.089449055,-0.008562979,-0.042811073,-0.3032231,-0.9561611,-0.012713037,-0.13158138,-0.011960352,-0.6015726,-0.35676977,0.5642923,0.8609863,-0.33122456,0.52372456,-0.13595884,-0.09165373,0.6497433,-0.10414546,-0.45241114,-0.028332587,-0.6362035,-0.7552313,-0.90223885,0.67549914,0.111896865,0.7712199,0.24993873,-0.20876229,0.1561781,-0.085315496,0.27853298,0.2564123,-0.46431845,0.99804157,0.6427984,-0.2688616,0.16006298,-0.35445705,0.22466719,0.9998835,0.12000421,0.103398,0.5847078,-0.39924604,0.026191272,-0.24182135,-0.99745536,-0.047384646,0.79342514,-0.42492223,0.39580855,-0.29764467],
    [73,1,"COC=C(C(=O)OC)c1ccccc1COc1cccc(C(F)(F)F)n1",0.68186533,0.1293834,0.03585765,0.30589202,0.003355092,-0.4949346,-0.08982893,-0.2789613,-0.15240808,-0.73156244,0.8048476,0.3395879,0.21015742,0.18238254,-0.14547902,-0.3306783,-0.25644958,-0.2578715,0.51999784,-0.15878351,-0.04699493,0.1302862,-0.080686726,-0.19035421,0.14177495,-0.16518037,0.6926511,0.3003737,-0.3143518,0.6419454,0.59831935,-0.7396827,0.343449,-0.52513415,0.49299714,-0.20908666,0.6742004,0.5353502,0.9992027,-0.4237418,-0.61039764,-0.0940951,-0.3925812,-0.45891577,-0.8661249,0.015072917,0.13228062,-0.033669244,0.9849368,0.7503914,0.4754276,0.3001072,-0.4186396,0.6193984,-0.4330621,0.2159918,-0.5921386,-0.58960235,-0.18845248,-0.36932847,-0.22041488,0.29694128,0.10101373,-0.63112575,-0.45788798,0.45768577,-0.4637084,-0.566147,-0.039906412,-0.52371186,-0.45958915,-0.9068926,-0.21976411,-0.48892444,0.11670516,-0.049445946,-0.57450956,-0.526484,0.2298136,-0.99978054,0.7032854,0.22306673,-0.9156782,-0.01338481,-0.09977779,-0.87553394,0.07994911,0.044124186,-0.21684566,-0.43946105,-0.088394664,0.20651433,0.5948664,0.8099453,0.9982,0.109349236,0.2985052,-0.7520692,0.40213805,0.73106986,0.08278471,-0.05610319,-0.88200307,0.9126926,-0.99747986,-0.91090167,0.32311422,-0.35295755,0.97205037,-0.071892545,0.18519995,-0.022308476,-0.7151461,-0.3292074,0.15301432,0.31473467,-0.5693757,0.3428848,0.97710794,-0.29884738,0.27345628,-0.23006994,-0.4250356,-0.17996377,-0.05370587,-0.037563384,-0.7106842,0.18226558,-0.006302615,0.99898314,-0.05267161,0.1304429,0.6641559,0.47821182,-0.31066155,-0.9840536,0.17728521,0.2710078,-0.40680516,-0.37118283,-0.9999525,-0.35335425,0.70118445,-0.08900571,0.29197443,0.46983024,0.37233257,0.13953567,-0.9820062,0.10884235,-0.34033293,-0.8305499,0.10554484,-0.68697214,-0.2648761,0.10355879,0.11946038,-0.42221162,-0.6479634,-0.96632993,-0.6553553,-0.38931984,-0.06366645,-0.3605512,-0.44074488,-0.36631978,-0.8123606,0.49279565,0.53449297,0.61587286,0.5400285,0.3569518,0.1591,0.6206041,0.18879993,-0.74220586,-0.64793736,-0.6736243,-0.4073596,0.16230051,0.35951155,-0.94182426,-0.6230415,-0.050641898,0.55728275,-0.2615055,0.66189003,0.6671172,0.01707735,-0.38738886,-0.060546283,0.052983657,-0.19577445,0.28533056,0.27302656,0.44038194,-0.23731755,-0.81363446,0.16689095,0.002824192,0.45176962,-0.30892897,-0.32360315,0.26373816,0.053685848,-0.13947394,0.16734327,-0.6546377,0.26580706,-0.9999409,-0.120540954,0.031179873,-0.51346797,0.21548334,-0.44114402,0.77789074,-0.51219314,0.10836674,-0.021595309,0.31981525,0.133764,0.08472647,0.26987666,-0.5162385,-0.9886183,-0.6073567,0.46504265,-0.546647,-0.5471894,0.7208026,0.033983245,0.73096657,-0.22602949,0.004573689,0.001215092,-0.18616237,0.10124721,0.2125708,0.069934934,-0.5125606,0.8842029,0.38021484,-0.4891101,0.40245724,0.4109141,-0.08294403,0.35142264,0.443119,0.29831713,-0.12252687,-0.09939683,-0.9698344,-0.6978334,0.42913947,0.41853765,-0.24446855,-0.65313065,0.17397137,0.04309468,-0.17427188,-0.18226747,-0.7615668,0.11038761,0.36842337,-0.28023642,0.7645089,-0.5676856,0.28730357,0.94578725,-0.5453275,0.13589472,0.9990366,0.450593,-0.037704974,0.011338857,-0.77747077,0.22925471,-0.49970642,0.20232056,0.32355544,-0.06946021,0.99338424,-0.41641766,-0.025749635,0.045627777,0.34805503,-0.104079954,0.8325342,0.7189945,-0.6150415,0.010336615,0.7941409,0.39162004,0.39550576,-0.3893092,-0.49831408,0.99998474,-0.9671993,-0.53186625,0.168579,0.26007572,0.4723146,-0.5075076,0.3395453,0.21023943,-0.5640196,-0.977264,0.55886,0.495642,0.6278387,-0.46339315,-0.49114293,-0.30601773,0.08647242,0.02726439,-0.10784492,-0.3961698,0.36897337,-0.99993306,0.033378843,0.00473656,0.4266524,-0.114997916,-0.7105868,0.49668404,0.8383719,0.47318992,-0.61414355,-0.6208339,-0.33868974,-0.48403433,0.10866399,-0.52522945,-0.042187825,-0.6170979,0.41728935,0.42090043,0.1409051,-0.39098334,0.15309368,0.5086019,0.44064328,0.5618207,0.5895709,0.23436087,0.2816323,0.5286708,0.25010714,0.31380892,-0.8521832,-0.8745039,0.6991983,0.05978881,0.09642637,-0.10397412,0.21536583,-0.024073793,0.99989146,-0.07614382,0.34234372,0.081800975,-0.44333762,-0.071150444,-0.29354033,-0.66276366,-0.44967064,0.27485555,-0.5170731,-0.119847246,-0.41927335,0.064029776,-0.6121716,0.40403783,-0.41205904,-0.28514957,0.99123526,-0.13711233,0.613275,0.64948744,0.7428098,-0.22588782,-0.05174021,-0.09904437,0.58249307,0.06713148,-0.75913477,-0.18115892,0.098311074,-0.19335365,0.49152538,0.72244316,-0.1493547,-0.52941537,-0.022941759,0.58237684,-0.7192361,-0.45985407,-0.14063007,0.010094128,-0.13069975,0.7947436,0.031345386,0.09107699,-0.6102967,-0.57131714,-0.5475464,-0.53822863,0.07717013,0.72310936,-0.23149727,-0.5400226,0.025010332,-0.2529771,0.032587517,0.003437647,-0.40583763,0.9999999,-0.53029585,-0.9319901,0.095611855,0.998316,0.10118971,0.40463358,-0.99989593,0.5974263,-0.7826236,-0.033861883,-0.6239614,0.5969694,-0.40985325,0.46344256,0.28893974,-0.40307567,0.14801925,0.37490213,-0.25196746,0.16732675,-0.008443934,-0.9999597,0.9959232,-0.12863737,-0.09783197,0.4601097,-0.23780751,0.5501292,-0.056329712,-0.33438608,-0.2046355,-0.5275601,0.5395989,-0.8079382,-0.08140827,-0.017856847,0.36718425,0.7252742,-0.41278046,-0.48026836,0.7562509,-0.99963856,0.31650862,0.37390152,-0.29978603,-0.3586853,-0.27131367,-0.58885604,0.28063032,0.11788967,0.5312988,-0.52738094,0.46029103,0.24155457,0.96989244,0.13858052,0.6673635,-0.04977351,0.047181413,-0.1808608,-0.06057969,0.2727168,-0.026258217,-0.15377764,-0.08019672,-0.9785344,-0.004288623,-0.013200474,0.4116726,-0.5167041,-0.23866211,-0.4257481,0.6572385,-0.122690685,0.47981244,0.40916878,0.99817663,0.32114643,0.5389059,0.019442918,-0.3902338,-0.6479184,0.9999063,0.5839309,0.33724687,0.007906994,0.44939953,-0.61053425,0.4401889,-0.9973922,0.29497617,0.41326597,0.001730878,-0.31895414,0.49336186],
    [74,1,"Nc1cccc(N)c1",-0.7217452,0.072336875,0.31127325,0.05065448,-0.29873323,0.18470187,-0.60769117,-0.25302517,0.19824268,0.014996602,-0.70910114,-0.5595849,0.18274839,-0.69651204,0.062259294,0.6821481,-0.13599718,0.51638854,0.113292746,-0.14672108,0.6105306,-0.9159917,0.3770377,0.31420127,0.10217351,0.41762275,0.15891248,0.5979679,-0.045802686,-0.21434309,0.3096067,0.3408717,0.17061272,0.0723914,-0.3974411,-0.47943595,-0.27756864,0.6156364,-0.9094164,-0.9398818,-0.92369753,-0.5516346,-0.35885867,-0.548062,0.19708677,-0.9967716,0.37658456,0.05010604,0.8526637,-0.4201962,-0.14851761,0.09543728,0.34714568,-0.23712364,-0.95923245,-0.15544088,-0.39648595,0.9777278,0.35181677,0.22701909,-0.34214285,-0.63831943,0.27820075,-0.4942666,0.72056925,0.38225943,0.19708033,0.5137425,0.09475836,-0.16638383,0.403395,-0.9981168,-0.046071444,0.37096357,0.049859073,0.42361742,-0.020290336,0.07047243,0.069043644,-0.9547783,-0.92954975,0.13781561,-0.83721,-0.3058554,0.28387392,0.8331229,0.18503645,-0.35439652,0.10026249,-0.13569082,0.14516051,0.20276019,0.1615642,-0.04811745,0.42797855,-0.36101043,-0.7330729,-0.047339078,0.7362693,-0.37810394,0.09220132,-0.6221864,0.05034458,-0.78807586,0.9918034,-0.062110975,-0.11503251,0.42743924,-0.99881244,0.10831772,-0.58073825,-0.29750654,-0.048661128,0.25280154,-0.2069086,-0.33073452,0.36909655,0.4499003,0.9985859,-0.1783851,-0.2702853,-0.3571882,-0.34286755,-0.024836099,0.012604469,0.039967805,-0.81416756,0.16877703,-0.22378892,0.9914137,0.05941701,0.007719174,0.044173237,0.0373384,-0.2079028,0.8849177,0.6345223,0.31136593,-0.6399445,-0.015800243,-0.99254054,-0.12923415,0.97373086,0.44830847,0.051546995,0.6039592,0.6877562,-0.60454553,0.9983614,-0.3044459,-0.2524737,-0.2832073,-0.19472156,-0.3088673,0.23027822,-0.034397747,-0.27116472,0.9993796,0.015282014,0.004435007,-0.99263096,-0.070300244,0.16748254,-0.09100922,-0.20701249,0.17940862,0.5112166,-0.13291562,-0.33116943,-0.083814375,-0.7465344,-0.09923236,0.66607183,-0.53792995,-0.16282946,-0.9456318,-0.84910685,-0.16961491,-0.6419036,0.098123275,0.31349072,-0.5817233,-0.03735564,0.3629091,-0.85268885,-0.56360215,0.42552066,0.24778834,-0.17753965,-0.113474086,0.951209,0.42840037,0.34519595,0.12538104,0.16493264,0.5045929,0.12798832,0.5949083,-0.2340071,-0.56552464,-0.20671628,-0.2186395,-0.7206899,0.019090557,0.077353545,-0.41522542,0.05498917,0.22493385,0.34585026,0.4203446,0.27508596,-0.3038754,0.14280072,-0.48796558,0.066053905,0.4067401,0.25258145,-0.25132754,0.21436946,0.15116839,0.062411904,-0.1845643,0.032465298,0.060011704,0.9999912,0.40488765,0.38627797,-0.1738332,0.321585,-0.71713597,0.089596,-0.2670647,0.40684083,-0.3538455,0.13533548,-0.5773427,-0.65071845,0.29823402,-0.18232055,0.36487374,0.89914536,-0.06869198,-0.24606618,0.21456508,0.57633615,-0.18709573,0.05439275,0.52933586,-0.35762656,-0.2138268,-0.35778505,-0.99584234,0.28235108,0.29058722,-0.37132415,0.4229687,0.26937217,0.40693095,0.3199193,-0.010540191,-0.51674926,0.68783087,-0.006170708,-0.3817615,0.54568034,-0.03157765,0.43239313,-0.009200406,-0.9981456,0.4378773,0.123036295,-0.90337044,0.07433162,0.47585064,0.18360244,0.95604825,0.25212806,0.46867257,0.30865616,0.70802164,0.10102431,0.9990064,0.23330961,0.72089094,-0.29109338,0.0588119,-0.5475272,-0.9291405,-0.7078486,-0.07408914,0.22705373,0.99926364,-0.114856765,0.7156477,-0.30352965,0.5315657,0.99763995,-0.50054425,0.12833078,0.17061326,-0.3035671,0.47796744,-0.18304099,0.23740396,0.38037598,-0.3763251,0.99957764,0.06823407,-0.50665367,-0.043428462,-0.21042365,0.08341389,0.40980065,-0.5341338,0.7267886,-0.2595039,0.055200726,-0.35462186,0.9503963,-0.039251324,0.1309014,0.40032923,-0.06340998,-0.25449455,-0.51713234,-0.0899343,0.47165745,-0.7879523,-0.341662,0.31247732,0.10183071,-0.5089064,-0.00633867,0.006213714,0.20268722,-0.6060125,-0.07250506,0.008227618,-0.28550163,-0.49836475,0.13865535,-0.1564465,0.014060323,0.61044264,0.10449077,0.20821185,0.06755806,-0.31434113,-0.026558604,0.96697086,-0.99337065,-0.3410571,-0.6198248,0.2275759,-0.03334509,0.3563131,-0.10927153,0.8578343,-0.047457147,0.102407575,0.15205547,0.24694012,0.59052426,-0.025783984,-0.32952288,0.030987991,0.031979278,-0.690373,-0.59546053,0.4903658,0.25850138,-0.3568322,0.4870669,0.9694949,0.10327306,1,-0.318735,-0.12413898,-0.36056474,-0.20206313,-0.8685577,-0.18938892,0.11996435,-0.6068774,-0.45750237,-0.365842,-0.3876184,0.002111871,-0.2698886,0.7456656,0.025993876,-0.27261567,0.24305749,0.57924235,-0.38491252,0.10317368,0.43417788,0.8212677,0.8625496,0.7366326,-0.8659548,0.23610246,-0.3869681,-0.13369757,-0.30998847,-0.1896408,-0.050547346,-0.17794967,-0.20840228,-0.11326386,0.8458533,0.46898952,-0.62667835,0.31501022,0.29105332,-0.09099854,0.8846766,0.036760103,-0.9934408,-0.096224934,0.9946456,-0.18571357,-0.40736347,-0.8955291,-0.24044982,0.76079124,0.46626005,0.06021994,-0.7123194,-0.12552136,-0.009369276,0.8233412,0.07575943,-0.5610535,-0.43230587,-0.07263847,0.19914086,-0.08421975,-0.99989283,-0.9990772,-0.9972147,-0.32109058,-0.10749069,0.15926379,0.29784468,-0.33456242,-0.7161006,0.5801107,0.15365931,-0.40072355,-0.7355989,-0.06672319,0.53558433,-0.37590706,0.49603757,-0.06878098,-0.5919026,-0.993987,-0.9998422,-0.5984419,-0.14989346,0.009111709,-0.6094431,0.14259933,-0.853756,-0.3878786,0.25686032,0.3061092,0.31124285,0.3318875,-0.33000588,0.8819868,0.47084993,0.78848773,0.047788084,0.44239655,0.41740713,-0.90243554,-0.18185902,0.5578412,-0.27021885,0.8180535,-0.6041994,0.16019443,-0.17025197,-0.14686643,-0.48614883,-0.21771206,-0.07296226,0.30252212,0.47089416,0.16393943,0.19134791,-0.987673,-0.1106736,-0.23484975,-0.100065954,-0.55742085,0.23745555,0.9985653,-0.00533823,0.21300413,0.1591,0.4103789,0.24875578,0.21218261,0.942372,-0.1338255,-0.7531643,-0.53668123,0.26713887,0.25033167],
    [75,0,"O=C(O)COc1nc(Cl)c(Cl)cc1Cl",-0.6466087,-0.15250628,-0.7438653,0.43895432,-0.20613842,-0.35578236,0.27124792,0.14961429,-0.07479958,-0.007706922,0.22452688,-0.4978665,0.19335714,-0.21259241,0.27150148,-0.665224,0.481773,0.55787843,0.578971,-0.030694596,0.5029368,-0.66511726,0.41893128,-0.1448978,0.17787543,-0.11166585,0.08432506,-0.32163775,0.35008562,-0.20830342,-0.2079059,0.72983617,-0.06428697,-0.048880678,0.52567196,-0.2293441,-0.27714908,-0.16603768,0.7933518,-0.9033632,-0.9909106,0.26721373,0.4196495,0.3728274,0.30334446,-0.9880962,0.095227174,0.01570724,0.8641604,0.12692086,0.16617884,0.5555616,-0.24818353,-0.49726662,-0.79509974,-0.30020463,-0.56898254,0.8705026,-0.124825455,0.26537633,0.7924786,0.021505067,0.5256166,0.0882086,-0.62935454,0.69334245,0.29568037,-0.02581773,0.39722925,-0.5986748,-0.8487717,-0.98101485,-0.013432412,-0.33054098,0.13724315,-0.0323043,-0.27354565,-0.51174533,0.3105631,-0.9990747,-0.32107946,-0.25069064,-0.7449152,-0.55107296,0.56746745,0.17930235,0.68908596,0.020000743,-0.28703108,0.2440689,-0.000171758,0.65157413,0.06962919,0.2602094,0.9978641,-0.3511547,-0.038747665,0.2209396,-0.15214472,-0.5608149,0.51216424,-0.40293297,0.40706027,0.006455761,0.56308395,-0.92142445,0.10998543,0.17950007,-0.9335146,0.5153828,-0.081749074,-0.56754464,-0.11130799,-0.55656534,0.07600955,0.1308672,0.6985671,0.57125777,0.9993365,-0.36298046,0.050635852,0.11295628,0.1020637,0.002738193,-0.42056164,-0.2440612,0.08990387,0.17169483,0.049061455,0.9974978,0.3709724,-0.30061063,0.5488743,-0.2880643,-0.056805987,-0.83086,-0.52944267,-0.5025772,-0.5098387,-0.21502738,-0.9988827,0.11153791,0.9411956,0.6641034,0.1713151,-0.105862066,-0.18059455,-0.6126738,0.9777384,-0.30297425,0.042398565,-0.36427557,-0.6026348,0.5356288,-0.6576448,0.3817518,0.25290057,0.9973652,-0.5280837,-0.7630767,-0.98596054,0.4290613,0.35924956,0.17195618,0.63755983,0.5078681,-0.39070576,0.1114539,-0.84836227,0.28829512,-0.582325,-0.08584287,-0.46912068,0.08364986,0.60242903,-0.8106466,-0.6564658,0.47161943,-0.447401,0.6354527,0.55620617,-0.9049296,-0.1155992,-0.019434717,-0.7626357,-0.3649296,0.30334148,0.23212615,0.18934157,0.00079325,0.63189805,-0.2985514,-0.0790806,-0.17986831,0.00258735,0.3074728,0.25042143,-0.4690865,-0.3141204,0.38858142,-0.71231747,0.33823547,-0.43717355,-0.45880672,0.59229034,-0.5636434,0.7939457,-0.054709125,-0.122951865,-0.9882539,0.57809836,0.45290473,-0.10340858,-0.24609357,-0.37663376,0.07196252,0.20562667,-0.2336318,0.48726287,-0.5882854,-0.5827137,-0.5103259,0.01863169,0.37780067,0.9882984,-0.4024556,-0.20391843,0.38511443,0.26621276,0.07189453,-0.3355838,0.104995556,0.15306811,-0.42723116,0.40055063,-0.4549045,0.3385082,0.5149339,0.024867592,0.20405777,0.8932469,0.079014696,0.20290618,-0.55680615,0.49442872,-0.07645673,0.5495264,-0.20656897,0.17391644,-0.2458457,0.45880112,-0.99880725,-0.49553785,0.4428829,-0.28715977,-0.52438474,0.38648322,0.4293692,-0.67866534,0.43004644,0.27638823,-0.18439874,0.15234509,-0.77349865,0.60156876,-0.23301862,-0.5456949,0.47520807,0.7602486,-0.042243086,0.77575994,0.5031026,-0.048186935,0.17069696,-0.33714932,0.8741559,-0.74831235,-0.39488637,0.047639888,0.20554836,0.073735155,0.9994612,0.21662098,0.5514872,0.14937346,-0.47743705,-0.11825309,-0.55564255,0.41129628,0.27751198,-0.39435208,0.99931955,-0.64851123,0.7120501,0.129068,0.239778,0.9980058,-0.860092,0.16949564,0.3783428,0.4786284,-0.35985398,0.004832006,-0.039464314,0.48253864,0.60628915,0.97631955,0.25802886,-0.07880734,-0.416303,0.35442868,-0.30059373,0.253465,0.5285238,0.12746383,-0.33992934,0.08423841,-0.24615668,-0.9526759,0.0684305,-0.5252529,0.58679616,0.5396078,-0.6953002,-0.46514904,0.16615324,0.43896192,-0.9297486,0.79831785,-0.471149,0.059034735,-0.07524807,-0.26986834,-0.0632012,0.49118176,-0.51859164,-0.11949836,-0.028173452,-0.10737421,0.5048215,0.23841687,-0.5953498,-0.33863413,0.025521925,0.3934891,-0.30327854,0.015715998,0.41837975,-0.21537533,0.7412836,-0.9940335,-0.014192903,0.5057923,-0.61433583,0.11871348,-0.10799923,-0.22204047,0.9986861,0.38278124,0.13699353,-0.08233922,0.6461799,0.54581815,-0.12220942,-0.34956682,-0.4702326,0.5442396,0.15875453,0.21674624,-0.15549624,-0.46098846,0.6301375,0.035454214,0.39581165,0.4919967,1,0.60553914,-0.75701725,-0.09607581,-0.6715165,-0.7812782,-0.36186936,0.17664935,-0.33469483,0.20245583,-0.41802186,-0.043857045,0.10593419,-0.56379086,0.592358,-0.07401296,0.3081701,-0.66757,0.46736997,0.57035774,-0.55730337,0.28916574,0.3822795,0.25724623,0.010042856,-0.14325507,0.15448378,-0.29346287,0.5172363,-0.27850482,0.06752914,-0.47522703,0.22520259,-0.48982835,0.63931906,0.22376621,0.2922018,0.71164083,-0.061926655,0.009174125,0.3269902,0.999913,0.070627555,-0.992007,0.45700854,0.9996802,-0.72926813,-0.41312551,-0.998487,-0.21925372,0.02216174,0.06260667,-0.27193928,0.12040818,0.012887569,0.5656176,0.25127044,-0.1196258,0.3318454,-0.16876656,0.30246118,0.31137124,0.24400792,-0.9999829,-0.9992077,-0.9903835,0.09548085,-0.09446948,-0.57078725,0.09362364,-0.08831113,-0.6710508,-0.51759154,-0.30904114,0.62774295,-0.469058,0.32697776,0.38379216,0.556708,0.19907,-0.16983339,-0.13107774,-0.95508,-0.99991107,-0.03177152,-0.022749864,0.4317457,0.22560948,0.7662008,-0.88178784,0.4786049,0.017794913,-0.61417747,-0.022135137,-0.20490515,0.4457831,0.94239265,-0.36330593,0.89413834,-0.37524825,-0.39273238,-0.6111438,-0.49439532,-0.44917023,0.36917144,-0.4009744,0.25758582,0.61178285,0.2056862,-0.67628574,-0.3090053,0.13136181,-0.21019235,0.35386235,0.66884726,-0.79945576,0.031852327,-0.08626269,-0.27133983,-0.08382484,0.31849164,-0.2669876,0.17669196,0.44753686,0.99997497,0.6477963,-0.4175883,-0.21388057,-0.08448551,-0.08834422,-0.19233887,-0.46916816,-0.12115723,0.20722051,0.61194694,0.29312462,0.0913959],
    [76,1,"CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1cncn1",0.17962286,0.05612053,0.027212622,0.21753217,0.7135505,-0.5732841,-0.3847686,-0.37271944,-0.38398778,-0.6627489,-0.34513256,-0.3908251,-0.4808782,-0.42830518,-0.14995465,-0.5257695,0.2532209,-0.4549906,0.62103045,-0.15265511,0.1539754,-0.40633878,-0.6605223,-0.6619668,-0.70178795,0.4718766,0.09632299,0.1759999,0.18633825,0.35103995,0.3509249,-0.35832125,0.14372334,0.2769169,-0.11551355,0.75117314,0.36620626,-0.07215698,0.99227417,-0.7997945,-0.83497167,-0.10877242,0.5255993,0.25332493,0.012351777,-0.75682384,-0.041161973,0.7176449,0.96568316,-0.38853598,0.67899203,0.31266665,-0.7507345,0.25741616,-0.6339134,-0.1768766,-0.49302393,0.15679488,0.044058032,-0.3651725,0.01831441,-0.33814907,0.2535862,-0.15858085,0.14498894,0.37229228,0.6332939,0.5195936,-0.6909246,0.49435207,-0.39834642,-0.96668273,-0.41119114,-0.031249896,-0.37333962,-0.23374847,0.17098434,-0.3818952,-0.57114476,-0.9997163,0.64377356,-0.5186869,-0.92197955,-0.55290544,-0.2511297,-0.58139306,0.4525268,-0.4685806,-0.6692163,-0.3006505,0.52568907,0.78366244,0.4555426,0.48528948,0.9971151,-0.32324278,-0.13509458,0.000843903,0.2773646,-0.39668474,0.20743103,-0.6034743,-0.28753662,0.9397304,-0.956252,-0.9507661,0.33760247,0.7723125,0.9913266,0.04821097,0.030049838,0.020021932,-0.32383657,-0.47600213,-0.5689087,0.5474925,0.41298023,-0.3797368,0.9968159,-0.005162101,-0.07602754,-0.102644086,-0.022445684,0.24315752,-0.4499077,-0.52714145,-0.13483107,-0.5667921,-0.3635035,0.998938,0.38314554,-0.5703608,0.073104635,0.05217969,0.07613428,-0.9763466,-0.4644318,0.24195288,-0.15150787,-0.49527377,-0.9999828,-0.2265666,0.82461816,-0.28198683,-0.25899366,0.20574662,0.15854457,0.31044218,-0.31201458,-0.29099464,0.50847256,-0.9317704,-0.22721143,0.244413,-0.06638112,0.12079202,0.6841074,0.86403733,-0.8172666,-0.914759,-0.93199,0.11741101,-0.73406905,0.059526198,-0.007382076,-0.609651,0.24934326,0.2974375,-0.27776456,-0.72407967,0.25929648,0.83755463,-0.22903751,-0.2873089,-0.37148702,-0.27285406,-0.60662526,0.15000913,-0.39686233,-0.3332326,0.58146155,-0.91178924,0.26675826,0.3989106,0.17695968,0.47259322,0.6012845,0.25952172,0.12205257,-0.50181085,-0.5776923,-0.7810213,-0.6728164,0.4084609,0.6636976,0.018127041,0.3380543,-0.70909274,-0.16396262,0.59052795,-0.24930151,0.17226014,0.37527522,-0.5259845,-0.020608103,-0.21493152,0.45583823,-0.018932678,-0.16789411,-0.9997303,0.124144144,0.757361,0.35361063,0.44690743,0.29759583,0.69980395,0.2439684,0.49359545,-0.052265603,-0.19317976,0.18585843,-0.547578,0.76704586,-0.5812101,-0.9811513,0.7154347,-0.49643198,-0.10732025,-0.15968406,0.52314246,-0.21616553,0.25708354,0.63857317,0.36890838,0.6200296,-0.64240175,0.5494116,-0.76856357,0.47832322,-0.2646053,0.9421952,0.16212378,0.664758,-0.5779906,0.49854982,-0.09217391,0.27202538,0.22984721,0.34497827,-0.3400637,-0.26132938,-0.96448934,0.42739633,0.25415593,0.1360843,-0.5415159,-0.5474339,0.47805074,0.4840238,-0.16774277,-0.17326464,0.47477922,-0.47748747,-0.45553437,-0.11769247,0.5824609,-0.6838707,-0.17062262,0.88782907,-0.19485533,-0.36366326,0.9881041,-0.5456604,0.4655174,-0.64520437,0.4076475,0.557878,-0.60642916,-0.002746012,-0.5625889,0.50067264,0.9986685,-0.023892986,-0.21288978,-0.29740447,-0.6346675,0.1682616,0.69312674,0.9692677,-0.43503398,0.093744725,0.989471,0.14207293,0.5124114,-0.089977995,-0.7724777,0.99999094,-0.9369566,-0.13161056,-0.006545388,0.26400098,0.55843055,-0.4911938,0.5329147,0.7853732,0.2524152,-0.45004356,-0.009278221,0.7034043,-0.004198628,0.24628842,-0.27318564,-0.7139215,-0.29331052,0.16637664,-0.08581509,-0.4162702,-0.5671817,-0.99995893,0.056646597,-0.23967458,-0.5463009,-0.43874633,-0.43220058,0.5289143,0.18962675,-0.083658956,-0.6530889,-0.1770476,-0.19526385,-0.22284248,0.07353917,-0.42139518,0.1804721,0.09118473,-0.05654836,0.54375994,0.34289092,-0.033087265,0.44988072,0.22579853,-0.40896696,-0.14357674,0.60673136,-0.002800779,-0.49818462,-0.6710571,0.16849156,-0.18171774,-0.36299565,-0.9595966,-0.023305243,0.2690329,0.40362495,-0.72133434,-0.2365344,0.04508506,0.9994905,-0.2508982,0.48355472,-0.2832717,-0.27392653,-0.3639305,-0.15597118,-0.55926055,-0.34457245,0.5575718,-0.30417657,0.65351534,-0.28435698,-0.053988732,-0.66088426,0.022056513,-0.34561852,0.5718322,0.9874369,-0.09084634,-0.6682882,0.5099414,-0.2318775,-0.235127,-0.29354906,-0.75820976,-0.32903042,0.025680277,-0.14563212,0.30579934,0.38870937,0.17434722,0.46061632,0.13106176,0.50330746,0.40860268,0.39282975,0.68055016,-0.6740303,-0.35396808,0.004787952,-0.16230875,-0.105152756,0.49242717,0.20463593,0.4142883,0.2623833,0.6147656,0.11052489,-0.7301017,0.010352226,-0.88174975,0.14753696,0.035578374,0.09323674,0.40864548,0.48667395,0.5006954,0.6690946,0.99999976,-0.6817867,-0.9729309,-0.2900481,0.99935997,-0.6888449,0.032462895,-0.9999189,-0.22079231,-0.4975815,0.18884741,-0.40870294,-0.45110214,-0.26232493,0.4936026,0.24244511,-0.122403175,0.037086774,-0.6741604,-0.71690583,-0.5993194,-0.31253988,-0.999978,0.9977052,-0.8056895,0.13194962,-0.63564295,0.22987945,0.6594486,0.007108866,-0.73081225,-0.546133,-0.3956859,0.78220403,-0.13770208,0.13806355,-0.2930918,-0.49238238,0.020790372,0.59759265,-0.45889118,-0.073012345,-0.9999068,-0.034242015,-0.07712321,-0.029471854,0.324264,-0.43025845,-0.6717829,0.3714704,0.11828344,-0.23969792,-0.21953559,-0.36765826,0.24995437,0.9684277,-0.11372646,0.6434552,-0.38860717,-0.5165615,0.009774249,0.23471366,-0.6829725,-0.39037114,0.50722873,-0.034815,-0.5382909,-0.3122445,0.033038087,-0.35486382,0.4497762,-0.5238998,0.2543854,0.38399675,-0.4541449,-0.17662671,-0.651531,0.96009356,0.25465804,0.20354825,-0.07027615,0.021411858,0.23206629,0.9999291,0.23398852,0.20562884,0.46582755,-0.44903424,-0.34817156,-0.44198158,-0.98960793,-0.36171475,0.51360166,0.011419736,-0.431468,0.11271523],
    [77,1,"Cc1c(-c2cccnc2)c2ccccc2n1CCCCC(=O)O",-0.5999096,-0.03231306,-0.056452874,-0.39264223,0.5348501,0.40403596,0.416388,-0.18130821,0.74093205,0.19318214,-0.78763956,0.32751873,0.40814257,-0.07628765,-0.36256295,0.73868424,-0.17233805,-0.33693892,-0.06894227,0.69514734,0.53782654,-0.232178,0.11117359,-0.017161567,0.5919719,-0.3601887,0.23598203,0.39603612,0.19745989,0.6355309,0.30666354,0.114916906,0.18104073,0.12022453,-0.080993935,-0.1612818,-0.1401891,-0.014359096,0.9977824,-0.79237163,-0.87401134,-0.74300104,-0.5031162,0.25189838,-0.12269736,-0.6722972,0.17723808,0.6368241,0.7644584,-0.28634813,0.22481108,0.24956337,0.05071253,-0.23393087,-0.7976969,0.053758953,0.6025461,-0.0547677,-0.5862486,0.34424788,-0.53050053,0.6871649,0.49375856,-0.49526027,-0.09119285,0.11601058,0.20303127,-0.09756085,0.49434465,0.8000977,-0.6167005,-0.7447818,-0.20782408,-0.76233447,0.33841136,0.041427948,0.49548063,0.27009782,-0.036489367,-0.9997653,-0.119061254,-0.65506285,-0.9163747,0.001129329,-0.007299069,-0.89544654,0.11430012,0.80472535,-0.7391036,0.18200697,0.32510465,-0.8046327,0.03748476,0.4513379,0.996918,-0.031167641,0.6333574,-0.07433222,0.2666754,-0.23712559,-0.11769935,0.18605785,-0.6326828,0.903138,-0.9848479,-0.3915671,-0.28475302,0.24333267,-0.8383715,0.4156183,-0.013864139,-0.17182149,0.7370245,-0.10183386,-0.001356169,0.1648111,-0.46896476,-0.07350842,0.9876845,-0.011681535,0.22944775,-0.6925084,0.26963913,-0.19776125,-0.60664463,0.49694273,0.26815632,0.7172657,-0.006791825,0.9998003,-0.17169784,0.26121968,0.5141508,-0.12871337,0.5750188,-0.95287776,-0.27921575,0.11537007,-0.16313311,-0.49921548,-0.99998635,0.052497093,0.82348514,-0.081333645,-0.37700167,0.12840743,0.28733844,-0.14830473,-0.7283975,0.4274843,-0.4495613,-0.54470897,0.6431381,0.5865025,-0.30001447,-0.054451123,-0.19932848,0.28376567,-0.57459384,-0.78815866,-0.85376734,0.23710144,-0.49546316,-0.087315395,0.36005294,0.34152642,0.3238238,-0.46989134,0.15042105,0.28114167,-0.35071063,-0.49351072,-0.051195897,0.6038781,0.4026805,-0.8439808,-0.26690474,0.64533776,-0.093893,-0.09272603,0.07005755,-0.8963163,0.5812239,0.43126968,-0.26462522,-0.77025044,0.075647205,-0.026652928,-0.16077013,0.102680296,-0.21383841,0.22919454,-0.18322362,0.6249486,0.13524556,-0.35257322,0.14166188,-0.61258805,0.5658941,0.31651464,0.837613,0.00313075,-0.33325312,-0.13268009,0.7069215,0.76544225,-0.34016642,0.08041098,-0.49980164,-0.99993014,-0.025160087,0.6107345,-0.06308564,0.30853793,-0.18569188,-0.22546217,-0.2079368,0.79297507,-0.58864164,0.27920488,0.17477849,0.01552881,-0.511905,0.6333222,0.97875583,-0.28316933,0.11762217,-0.1430351,0.0932738,0.47564742,-0.3697544,-0.18314537,0.5059236,-0.47047526,0.2658842,-0.323907,-0.03134221,-0.16204809,-0.190495,0.27341154,0.9037699,0.5096934,0.47037804,-0.5034272,0.37430397,-0.10343001,-0.11272398,0.116643496,0.5221081,-0.058642365,0.10127236,-0.74416184,-0.5046718,-0.06588438,0.013051493,0.21577236,0.043609995,0.41192654,0.36469758,0.08007266,0.44957176,0.63801587,0.44529793,-0.27859098,-0.34329858,0.061064024,-0.64673233,-0.6215467,0.9672937,-0.66202366,0.33196208,0.8950243,-0.08816498,-0.298273,0.8359527,0.6076412,0.23784442,-0.7985258,-0.9083954,0.36811492,-0.10145718,0.9974086,0.27615273,0.5576494,0.13893305,0.6882779,-0.52244407,0.7479031,0.3041998,0.5566004,-0.43951678,0.9291405,0.3498815,0.32536,0.17218594,0.41270652,0.99999744,-0.9906953,-0.18436559,-0.045953434,-0.5744047,-0.54441965,-0.62332743,0.17296325,0.20215358,-0.8507191,-0.91976994,0.4677261,0.2215382,0.15163115,-0.573016,-0.7620232,0.060841728,-0.42355078,-0.08917539,-0.04767989,-0.50228083,-0.13090979,-0.9815595,-0.43939823,0.20065473,0.8056452,-0.36746225,-0.4940874,-0.75222635,-0.18264835,0.50296533,-0.9559222,0.06817075,0.27572948,0.33917162,0.19526206,0.6337719,-0.7354401,0.32138506,0.7363915,-0.04755752,-0.2908856,0.05453117,0.42992762,0.005825284,0.041896682,0.043786857,0.5218763,-0.007664261,0.18024214,0.53164035,0.29746464,0.49730763,-0.60723597,-0.96377444,0.66436577,-0.037818734,0.1573858,0.4013285,0.7594823,-0.26847672,0.9996946,0.12844029,-0.16839668,0.12866971,-0.5656359,-0.42403424,0.67487115,-0.8249264,0.27931163,-0.5407414,-0.24961452,0.23816377,-0.30205157,0.6506208,0.13497257,-0.22329134,-0.51092637,-0.40336755,-0.99615884,-0.6448442,-0.07326352,0.37417766,0.1300386,-0.33649635,-0.70343536,0.29130626,-0.2777114,-0.37374988,0.13984595,0.29536104,-0.36346218,0.3061209,0.7184248,0.47841194,-0.3834088,0.35460556,0.14247534,0.22649091,-0.5048582,-0.27785307,-0.6212235,0.12399765,0.06369,0.105705105,0.014803323,0.7543126,-0.101805896,-0.64456123,-0.46482682,0.2704894,-0.8392106,-0.17769195,0.5941913,0.69527537,0.44759667,-0.49223277,0.02392537,0.19616023,0.07916693,0.9999743,0.23792084,-0.9836774,0.27408022,0.99907446,-0.6924152,0.22768234,-0.99942905,-0.5291632,-0.3861233,-0.562779,0.22390118,-0.70108014,0.27255204,-0.7135927,-0.40238696,-0.5488051,0.012357046,-0.6152132,-0.33290774,-0.09444262,-0.22312963,-0.9999428,0.9999996,-0.41105917,0.40655804,0.52624077,0.35611737,0.52308816,-0.5443865,0.11941017,-0.15843278,0.35102996,0.46204463,-0.43396935,-0.57217884,-0.46249524,-0.5706989,-0.3485255,-0.25606927,0.03501426,0.45948952,-0.9998217,-0.415819,-0.7689613,0.3317417,0.2383069,-0.09443409,-0.94175535,0.36478257,-0.6394188,-0.5466874,-0.21317138,0.09299525,0.2504982,0.9872278,-0.09077419,0.5431304,-0.26510295,-0.22063643,0.38525677,-0.3581048,0.5172474,0.118912004,0.22350048,-0.16009684,-0.16098887,0.42018688,-0.38903847,-0.0914556,-0.050724298,0.495274,-0.23282272,0.55534685,-0.048737694,-0.125082,0.3300502,0.9943514,-0.48119968,0.59360933,-0.14672878,0.59694517,-0.0950232,0.99989176,0.7707779,-0.6165166,-0.333243,0.13545312,0.23036012,-0.09106951,-0.99535197,-0.23904516,0.7634144,-0.07972234,0.6258021,0.5898758],
    [78,1,"N#Cc1cc(Br)c(O)c(Br)c1",-0.652376,0.2596434,0.25170043,0.24082755,0.0961209,-0.10955345,-0.19114602,0.064793296,0.15528779,-0.001111955,-0.5374731,-0.23096986,0.06424826,-0.6114537,0.48097673,-0.11481823,-0.314751,0.30242395,-0.17958245,0.15544268,0.44872096,-0.67975444,0.81476533,-0.20369373,-0.2786367,0.84593993,0.1347593,-0.057918847,0.60984945,-0.15345757,0.013033956,0.539748,0.34421661,0.17473613,0.14351882,-0.18866381,0.4609347,0.3496302,0.3492394,-0.9250254,-0.9962947,-0.53164124,0.42089036,-0.456543,0.5072254,-0.9952973,0.1613488,-0.11638807,0.83967364,-0.09575569,0.13982944,-0.019753292,-0.4464796,-0.24173036,-0.9231243,0.08562136,-0.7630778,0.8938707,0.16588666,0.21423948,0.1946105,-0.5663887,0.4543176,-0.16791497,-0.18013895,0.45197013,0.27334803,0.6217327,0.25150952,0.7310919,-0.30731612,-0.97514683,0.2012683,-0.05658727,0.6506297,0.12917484,0.49377614,-0.5108379,-0.3375138,-0.9966063,-0.6175336,-0.61431396,-0.9234351,0.45296127,-0.6836991,0.13244201,0.55365014,0.10076274,0.09716568,-0.60033625,0.23018155,-0.33536875,0.08409464,-0.18653688,0.9174251,0.12232783,0.3274164,0.18025488,-0.06825047,0.32895467,0.73415273,-0.5639716,0.3645745,-0.81989956,0.8946142,-0.3890857,-0.37646505,-0.4394473,-0.9804149,0.1811529,-0.818253,-0.6787213,-0.289531,0.5566108,0.6293134,0.21093073,0.47979656,-0.21666718,0.99968827,-0.60521823,0.05871226,-0.4085196,-0.16305888,0.19528405,-0.49371308,0.017417924,-0.33221686,0.6905358,-0.37902552,0.99706566,-0.32018283,-0.52076316,0.1759322,-0.49240765,-0.14573118,-0.6148227,0.40630063,0.05557815,-0.56911343,-0.37380168,-0.9990496,0.008845988,0.98950726,0.57276493,0.2797161,0.18866362,-0.31842652,0.20925897,0.995743,-0.12044714,0.06812528,-0.4447698,-0.36131358,0.38045785,0.45499727,-0.17122707,-0.026956975,0.9991611,-0.4452221,-0.66739815,-0.9921162,0.01704366,0.48160574,-0.38736963,0.4926138,0.2513683,-0.06556619,-0.42124987,-0.22875562,0.16903007,-0.69544065,-0.17903602,-0.011412932,0.09480426,0.43980092,-0.9495194,-0.869218,0.044494305,-0.4648658,-0.06812885,0.5794918,-0.4178756,-0.34930205,-0.029906243,-0.81426316,0.025287513,0.5737143,-0.017279461,-0.23990355,-0.5313963,0.8918822,-0.026701378,0.16881967,-0.11107849,0.17639023,-0.19876073,0.5632576,0.26758146,0.041205138,0.004833386,-0.8305213,0.25737238,-0.096799396,-0.41698724,0.12816435,-0.36078477,0.4564137,0.3907222,0.49991006,-0.89701724,0.4171239,0.1268454,0.37003496,-0.40142822,0.097632356,0.26221702,0.22676274,-0.08158533,-0.5517446,0.23712668,-0.18374856,-0.2814512,-0.015729873,-0.20900895,0.99949497,0.30970603,-0.15832037,0.28597945,0.17177151,-0.4494822,-0.40620998,0.025144614,0.66652006,-0.5044674,0.019307276,-0.7354681,-0.15559861,-0.13169643,0.23407555,0.054251157,0.9004807,0.37451777,0.1291815,0.06329587,0.58550507,-0.02440831,0.66516167,0.5345278,-0.32617116,-0.23221523,-0.24682373,-0.9989172,-0.4278547,0.40813828,-0.64628035,-0.3397562,0.60312814,0.010012869,-0.11221236,0.59456956,-0.7700789,0.6323384,-0.18352015,-0.5331741,0.81283575,-0.40646565,0.55294424,0.42525017,-0.437205,0.47299713,-0.16465926,-0.052524608,0.32777092,0.43076432,-0.42381385,0.83385515,-0.41557008,0.42821974,0.27073604,0.26102313,0.5495484,0.99950564,0.013637166,0.65040636,-0.23336332,-0.27184078,-0.52136415,-0.08874152,0.3280536,0.17359117,0.37861717,0.99963087,-0.2939337,0.90429926,0.21234989,0.20327267,0.999041,-0.9320135,-0.25426635,0.3288448,0.00935515,0.02288825,-0.23201694,-0.00017282,0.4180674,-0.21894978,0.9971401,0.35145232,-0.81676626,0.1155461,0.409905,0.32217452,0.31099147,-0.20850019,0.75578403,0.4565917,0.007995945,0.051088393,-0.977864,0.29632425,0.51379806,0.08204523,0.013291298,-0.48020598,-0.18883592,-0.23397882,0.5541379,-0.93959004,0.010754578,0.21150613,-0.590899,-0.37469384,0.26945153,0.18103625,-0.11086547,0.022686932,-0.003134525,-0.7536047,0.18021807,0.25553408,0.11038226,-0.22471248,-0.2207067,-0.26808637,-0.45497715,0.024915136,-0.40068442,-0.19918136,-0.38197914,0.9233989,-0.995606,-0.4863051,-0.4068766,-0.18103568,-0.108069256,0.49154896,0.0235034,0.996598,-0.12887011,0.48854396,0.1664249,0.6537152,0.46113476,0.3440175,-0.71342033,-0.008226985,-0.41571718,0.35585898,-0.26986372,0.43840718,0.23038788,0.6461525,0.62665296,0.9128277,0.2357034,1,0.46587285,-0.25922793,-0.23524936,-0.16196962,-0.94784987,0.028586505,-0.573943,-0.5304511,-0.24446145,-0.11910862,0.06718166,0.47887582,-0.44137567,0.8443787,0.15638976,0.49983898,0.1090916,0.50803065,-0.058081537,-0.3650391,0.25103247,0.63041776,0.9030693,0.35042092,-0.90255123,-0.6064174,-0.49668038,0.48094037,-0.53555137,0.027653387,-0.31256485,0.04192447,0.3099506,-0.482027,0.56275946,0.21816817,-0.4483286,-0.25767592,0.2998305,0.5342285,0.99996465,0.29707405,-0.9904248,0.39560062,0.9993044,-0.7800205,0.08210088,-0.9984993,-0.43295044,0.70935917,0.57611644,0.416997,-0.5948395,-0.26918995,0.4403707,-0.12036024,0.4106504,0.15848197,-0.57618755,-0.28222102,0.60545033,-0.21821149,-0.99997354,-0.9992434,-0.9975833,-0.16922213,-0.10556975,-0.4863719,-0.038858607,-0.28740355,-0.81450486,-0.22658077,-0.1425187,0.32308608,-0.8346899,0.11468445,0.251884,0.17575994,0.5882076,-0.38347325,-0.4764581,-0.98922443,-0.9999594,-0.18150227,0.026817057,0.03035646,-0.08800194,0.19830848,-0.95819026,0.6120402,-0.18564829,-0.046367306,-0.26257017,0.4586627,-0.21367162,0.9450055,0.032834604,0.66250116,-0.16350648,0.38609415,-0.4529365,-0.40073562,-0.34539014,0.08346264,-0.57405365,0.14643745,0.5322295,-0.18421996,-0.14217673,-0.7489524,0.39373276,-0.04928071,-0.2781323,0.6934777,-0.35300854,0.4431322,-0.046656426,-0.87772804,0.20402327,0.16621831,-0.49390343,0.4200555,0.25507322,0.99956876,0.1361349,-0.16948041,0.065437436,0.4616518,0.31438217,-0.12625504,0.52506745,-0.539779,0.35761362,0.71667343,0.64585376,-0.3760842],
    [79,1,"COc1ccc(C=CS(=O)(=O)NC(=O)c2ccc(C)cc2Cl)cc1",0.71371746,-0.1397758,0.33585167,-0.056067485,-0.27404955,-0.05789021,-0.07716549,-0.67401606,0.3835634,-0.6343225,-0.105494015,-0.41034976,0.27580604,-0.26711273,0.21738859,-0.54403406,0.35030982,-0.07144844,0.24903521,-0.49822202,0.5716117,-0.26663962,-0.21361706,0.243779,-0.119625695,-0.2952438,0.54761726,0.122297674,-0.5174791,-0.83264005,-0.38134274,-0.5597909,-0.15219262,0.094213,0.78337705,0.13632223,0.009833934,0.59674907,0.99922466,-0.07974597,-0.9333355,0.4481863,-0.72110903,-0.021571938,0.30920544,-0.20504756,0.26151732,-0.32393,0.9247791,0.4753684,-0.16064762,-0.15531428,-0.6087798,-0.11801583,-0.43277442,0.18776701,-0.1391935,-0.5381266,0.65914816,0.10349728,-0.23058291,-0.010717128,0.30941293,0.2613931,-0.60432255,0.568009,-0.441755,0.08713898,-0.39582554,0.5491123,-0.45472446,-0.97874635,0.57085687,-0.06180953,0.55806,-0.30397934,-0.24064536,-0.5118325,0.29853877,-0.99993736,-0.43731594,0.000655591,-0.721524,-0.584716,-0.28125897,-0.8437174,0.2152042,-0.386725,0.15710562,0.13120872,0.041151926,0.13027275,0.53945327,-0.4594717,0.99872106,0.5334508,0.124525316,0.10533602,0.17304982,0.16993624,-0.07426383,-0.20533343,0.4524313,0.95705086,-0.9920142,-0.7864066,-0.6318491,-0.32561293,-0.9584759,0.3406663,-0.29049656,0.11585431,-0.50839555,-0.041237954,-0.04712445,0.4704113,0.5952792,0.3853786,0.9827487,-0.20129226,-0.6229328,0.24514611,-0.18015757,0.2781153,-0.3566585,-0.19865228,0.09699668,0.4076386,0.27944463,0.99963135,0.211132,0.6110304,0.52209044,0.17522337,-0.31445643,-0.96458805,-0.009430098,0.15877639,-0.639965,0.12196575,-0.99990386,-0.39596695,0.42141655,-0.16125494,-0.06529685,0.43720415,-0.009445636,0.1878145,-0.92321527,0.28924543,-0.4015742,-0.02044992,-0.40366986,-0.13416776,-0.4985204,0.40209022,0.19528566,-0.03601981,-0.7513483,0.48150378,-0.62533355,0.47084063,0.23866074,-0.14185776,-0.04263167,0.38425332,-0.32221675,-0.32241985,0.57965565,0.29136053,-0.16211444,-0.44961968,0.51288277,-0.4297899,0.23962454,-0.9144294,-0.40712258,-0.39696175,-0.26674515,-0.078786254,0.44875357,-0.9867177,-0.38697335,0.63375145,0.028226368,-0.60404617,-0.15865889,-0.3779961,0.20963646,0.36131003,-0.47828892,-0.17710748,0.15842503,-0.061914276,0.09445738,0.31338096,-0.472825,-0.7510075,0.48780718,-0.40082335,-0.020692136,-0.81632584,-0.5568216,0.52399975,-0.30999944,0.08838439,0.43563402,-0.29479071,-0.619708,-0.99993205,0.1592601,0.21704042,-0.013858261,0.06264346,0.06876012,-0.19515994,-0.2953076,-0.07649253,0.24336483,0.19429332,-0.48447677,-0.12680791,-0.5842977,0.19015461,-0.9209452,-0.04893745,-0.09081773,0.5199038,-0.12711771,0.15811019,-0.65606755,-0.37799,-0.14193076,0.095284775,-0.48023552,0.066861935,-0.20947188,-0.1534755,-0.34225488,0.36926672,0.78585285,-0.2122744,0.12130132,-0.6206771,0.3496983,-0.06647595,-0.18284474,-0.12892096,-0.002046912,0.15666124,0.7331452,-0.9773297,0.08140685,0.82782996,-0.63881534,-0.23392917,0.6728342,-0.6490635,0.30370703,0.6741324,-0.71203655,0.5485786,0.26010978,-0.40891647,0.16690257,-0.002853002,0.10485825,0.12867495,0.84197515,0.5570777,0.22445773,0.9672554,-0.25979173,-0.7049786,-0.4504883,-0.75406325,-0.5441177,0.49570417,0.16850814,0.5562713,0.52733094,0.99550414,-0.59124655,-0.3535584,0.1703555,-0.51767015,-0.5549414,0.17770764,-0.9474154,0.13960612,-0.14512357,0.9006025,-0.13791595,-0.059857704,0.4858113,0.2558471,0.9999446,-0.965138,0.8137625,-0.14028792,-0.6580289,-0.3165102,-0.49823305,0.3281464,-0.24025244,-0.3458216,-0.9649063,0.20498052,0.8379644,-0.42286888,0.3420431,0.4340043,-0.4105027,0.011331568,-0.66943526,-0.39317954,0.7227215,0.67937773,-0.94430923,-0.08799643,0.4888909,0.6103264,0.08374847,-0.48552376,0.17085406,-0.46245804,0.59311867,-0.86038357,0.4548141,0.6070167,-0.42838505,-0.04080364,0.17317142,-0.38819426,0.5753021,0.109561615,-0.46088013,-0.21169561,-0.5920482,0.6548919,-0.17479235,-0.5229542,-0.19389924,0.5780669,-0.34460348,-0.04209875,-0.66788936,-0.064182915,-0.5130563,-0.9106801,-0.90506595,0.39630178,-0.14906088,-0.33656392,-0.51202935,-0.77279574,0.5969076,0.9996263,0.21223941,0.1432199,-0.05231854,-0.06126115,-0.23069145,0.37677056,-0.808956,0.10867514,0.3555018,-0.15011257,-0.21481037,-0.06772306,-0.17590018,0.5187065,-0.013947229,0.15457252,-0.3077935,0.99727744,-0.2707838,-0.003025288,-0.07322925,0.218404,-0.12649931,0.22290951,0.20130691,-0.6922605,-0.24893808,0.08930284,0.077000566,-0.2835647,-0.18496217,0.4766026,0.5000874,-0.14825651,-0.15511209,-0.092116304,0.2368859,-0.6550688,0.27081802,-0.18401061,-0.62013716,0.3187549,0.8225145,-0.33053452,0.6916629,0.2475501,0.365209,-0.017628543,-0.76284903,0.1793001,0.109429576,-0.57762516,-0.16776088,-0.45102957,0.29455245,0.24168043,-0.7372704,-0.296516,0.99995214,-0.12912114,-0.9577296,-0.4159028,0.99981385,0.13728814,-0.7868342,-0.99946284,0.04408125,-0.7517482,0.12090157,-0.17238268,0.3580344,-0.5090263,0.24461728,0.3219988,-0.5557736,0.29855636,0.24278194,0.15989439,-0.48054203,0.34741402,-0.99997896,0.99615514,-0.09581286,0.11225159,0.25109142,-0.31421852,-0.2776075,-0.3659542,-0.77419245,-0.008089781,-0.36225158,0.10622708,-0.6894934,-0.04379723,-0.07630046,0.78397995,-0.20710282,0.48933214,0.13037007,0.6982088,-0.9997173,0.659048,0.6881392,-0.666574,0.2961343,-0.24350944,-0.5980421,0.6266881,0.4514757,0.38660723,-0.097571604,-0.024090042,-0.34245217,0.95565706,-0.103512384,0.73231363,0.12322512,-0.24402584,0.32499656,-0.3335284,-0.34475723,0.0808166,-0.47983375,-0.12240668,-0.14933233,0.59666747,0.199505,-0.39718014,0.19679797,0.1838883,-0.04860847,0.5821846,0.3687389,0.23937526,0.06300713,0.99757797,0.25753614,-0.25338572,0.47597146,-0.40449747,0.69025075,0.99993837,0.1343792,0.4185273,0.42697507,-0.08976574,0.12293636,-0.48775288,-0.9930911,-0.26369455,0.5276999,-0.1335714,0.3994485,0.19124322],
    [80,1,"O=S(=O)(NC1(C(O)=NO)CCOCC1)c1ccc(Oc2ccc(F)cc2)cc1",-0.52282596,-0.29000485,-0.5457312,0.74092776,0.09161164,-0.46027082,-0.27167076,-0.25656593,-0.30378225,0.011032585,-0.13624933,0.65911007,-0.5071337,-0.4783644,0.39710188,0.5505091,-0.3520546,-0.22958471,-0.21958366,-0.39441293,0.584995,0.5563162,-0.5133898,-0.7314156,0.008284755,-0.20857102,-0.21350981,-0.26889265,-0.015888385,-0.6047558,-0.43891883,-0.44145304,-0.49047115,0.1483479,-0.17941001,0.15716684,-0.003067692,0.3248169,0.999631,-0.00868116,-0.34706166,0.16815901,0.17423251,0.38888183,0.44002196,0.6303955,-0.1824764,-0.01279508,-0.4630497,0.48454362,0.4552589,-0.32469943,-0.16141751,0.5032369,0.32782605,0.34232816,-0.55734795,-0.907732,-0.10404479,-0.72845507,0.16942921,-0.44404665,0.20710143,0.29127303,-0.40523815,-0.16882004,-0.6924868,0.36862558,-0.7099955,-0.069562055,-0.939747,-0.9897756,0.74871826,0.34782702,-0.17409793,0.5409822,0.04179731,-0.023066016,-0.5269287,-0.9969834,-0.44352576,0.05560612,-0.868585,-0.27503356,-0.016502934,-0.6359136,0.24803054,0.59979093,0.038735304,-0.42613563,-0.46090734,-0.14137441,-0.16729137,-0.13882057,0.99993867,0.7937215,-0.41900587,-0.5010087,0.14288482,-0.6180845,-0.3657608,-0.6747504,-0.5338937,0.98424435,-0.99882805,-0.77663374,-0.16253917,-0.16815227,-0.99999785,-0.48846826,-0.6876605,-0.50461066,-0.52736247,-0.15681607,0.281143,-0.39226544,0.30963933,0.7331791,0.9221132,0.39519823,-0.6200102,0.30624056,-0.5475656,-0.04584268,-0.7122784,0.6889947,0.2635598,0.08494101,-0.031935204,0.9919707,0.29419988,0.110996224,0.5247152,0.51852626,-0.62496907,-0.9138477,0.1648284,0.32557037,-0.42169124,0.37822548,-0.99999934,0.15144192,-0.5284418,-0.7706833,0.70266336,-0.6908044,-0.2239307,-0.24752638,-0.9913468,-0.3646386,0.76409507,0.47675425,0.68739253,-0.69508183,0.20851299,-0.7443478,0.68621033,-0.8725301,-0.72347623,0.7400055,-0.22118108,-0.102916904,0.3989834,0.30675125,-0.18412921,0.040621515,-0.7851926,-0.0537194,-0.29731742,-0.18688662,0.35629663,-0.25877246,-0.3423631,-0.13484453,0.062270492,-0.9140791,0.47397238,0.08957353,-0.4752386,0.25296313,0.46979854,-0.9968903,-0.7472402,0.13500209,0.8694605,-0.003555128,-0.006939477,-0.11914804,-0.5020655,-0.5082397,0.5721967,-0.2359099,-0.309674,0.11170439,-0.25531968,-0.759061,0.037738167,0.8562415,0.32554677,0.42095983,0.20263676,-0.50432426,-0.6158743,0.25676256,0.75405204,0.8315944,0.06935507,-0.029837728,-0.02242637,-0.9999125,-0.05790525,0.026510494,-0.68667406,0.21375844,-0.09035249,0.008709291,0.2735338,-0.6857021,-0.37742424,-0.22572082,0.534355,-0.29753244,-0.70635927,0.72324866,0.9999941,0.4081585,-0.038141333,0.8859424,0.71691555,0.83800656,-0.08191856,-0.08955007,-0.50449735,0.09590025,-0.250335,0.47156554,0.3899679,0.22835027,0.5241695,-0.079004295,0.80494493,0.09037765,-0.25730243,-0.7579019,0.19566119,-0.16305146,0.33679014,-0.63056886,0.33725032,-0.1694291,0.35815632,-0.69340813,-0.060774162,-0.23981512,0.6148409,-0.22660142,-0.1694999,0.111999415,0.08550765,-0.4834542,-0.7146998,0.4900415,0.046380997,-0.17594649,-0.05708617,0.4234986,0.63603115,0.809988,-0.91562974,-0.4341134,-0.3052577,0.9976733,0.4830846,0.58787173,-0.20340465,0.8717046,0.074671,0.604697,0.55854243,-0.28445897,0.16583581,0.9725997,-0.5609616,0.48732528,-0.5060333,-0.017028512,0.6878425,-0.83244675,-0.999641,-0.48197007,0.27092803,0.20805834,-0.003120763,-0.44505385,-0.01651862,-0.23883414,0.9999997,-0.8235147,-0.5606802,-0.261496,0.029564535,-0.10993606,-0.67608553,0.7292971,0.41508186,0.17702836,-0.99649256,-0.30690974,0.7650198,-0.043236364,0.30577663,0.72632194,0.063863315,0.42876107,-0.8801012,0.0951113,0.0972807,0.05728828,0.99998736,0.41006482,-0.048809588,0.4485818,-0.14565374,-0.8890235,0.46866482,0.3221974,0.2936651,-0.34181035,-0.23766929,-0.24077138,0.04151617,-0.15271945,-0.20504467,0.054141577,0.72040033,-0.59255236,-0.72483885,-0.0673176,-0.5096098,-0.054568846,-0.38569993,0.17179137,-0.14559929,0.774714,0.41392866,-0.3908415,0.05960123,0.12538095,-0.32646295,-0.97539717,-0.5023533,-0.5241634,0.8860738,-0.15909347,-0.3159208,0.25381923,0.16805086,0.9999294,0.38925385,0.5240907,0.016704442,0.75464344,-0.23690256,0.018333722,-0.5803355,0.21793057,-0.31982023,-0.42825177,0.6537383,0.1436752,0.33331978,0.96287155,0.64008176,-0.51141393,0.6052766,-0.99522746,0.4932381,-0.48964792,-0.76424485,0.43368718,0.74697214,-0.6367744,-0.08442604,0.084690176,0.11684723,0.37849754,0.22928044,-0.4195752,-0.41975144,-0.15216693,-0.52062947,0.5413972,-0.1193841,0.117135,0.38733947,-0.38248307,-0.69556266,0.53084975,-0.3156406,0.6006392,0.99434394,0.67469037,0.58466613,-0.12060561,3.96e-05,-0.4598205,0.040103935,0.090227045,0.21484847,-0.5378181,-0.49707934,0.6011362,-0.15745185,-0.24613675,0.04492959,-0.4269282,-0.98874855,-0.15184976,-0.990161,-0.39584625,0.99977434,-0.3180067,-0.5498468,-0.54585946,0.1377217,-0.2875623,0.24042207,0.23803598,-0.4750963,0.312332,-0.26845855,0.2126251,-0.47268832,-0.08958017,0.14568935,-0.7512025,-0.23296243,-0.79851294,-0.9999333,0.9999997,0.5626788,0.2613255,0.27482685,-0.65436476,-0.6621557,-0.020294355,-0.46078622,0.12385195,-0.023487255,0.6937763,-0.92982584,0.45580527,-0.77406174,0.49359763,0.44930038,0.4194112,0.13286158,0.93239546,-0.99901795,0.064476795,0.23178175,0.11942748,-0.70244676,-0.3509506,0.6321605,0.5243914,-0.24783933,0.7760511,0.7204609,-0.47037697,0.5488434,0.9547348,0.21347015,0.60306704,0.10575426,-0.076466545,-0.31480527,-0.7602852,-0.6672203,-0.7676501,-0.7214711,0.4553801,-0.37589544,0.31915486,-0.2662325,-0.6047619,-0.25160828,-0.18560465,0.12116158,-0.56383425,-0.42750868,0.25522786,0.53901345,0.9990967,-0.36391684,-0.19071914,0.107303634,0.095242225,-0.19543116,0.999753,-0.13388194,0.42838565,-0.35419604,-0.29326996,-0.23682325,-0.16838084,-0.9977809,-0.072355695,-0.35225922,-0.24522495,0.1476538,-0.7800099],
    [81,1,"O=C(O)c1cccc(N(Cc2cccnc2)c2ccc(OC(F)F)c(OC(F)F)c2)c1",-0.445225,-0.40766552,-0.7222965,-0.63889444,0.26723936,0.029652592,-0.6257136,0.31100354,0.30416942,0.57273144,0.20047475,0.17241651,-0.5946058,0.015305751,0.61833495,-0.38466224,-0.1386554,0.3790418,0.06500713,-0.6484557,-0.13327692,0.39861196,0.10379865,-0.15552521,-0.3413869,0.4856274,0.44879407,0.24236192,0.10990035,-0.04123005,0.2462218,-0.13192855,0.14365484,0.14085141,-0.6849077,0.24812116,-0.4348421,0.73464656,0.99962044,-0.48184907,0.019113446,0.20230909,0.7134542,-0.02038142,-0.43330094,0.80405337,-0.4170063,0.18850976,0.11950353,0.33735988,0.3672294,-0.14818487,0.25075984,-0.52894807,-0.2988694,0.2687573,-0.6725832,-0.9231452,-0.698807,0.17152606,-0.6806704,0.37637088,0.32777256,-0.7404647,0.10766696,-0.49824914,0.50567734,0.15289089,0.23734403,0.058479883,-0.9598225,-0.23664416,-0.5211059,-0.6798004,0.5594504,-0.45498252,0.33476713,0.07042889,-0.5327419,-0.9864389,0.6120363,-0.72518635,-0.83723384,-0.3746744,0.16767557,-0.9516099,0.6204589,0.5921929,-0.61497504,0.67697173,0.6852964,0.096049145,0.76777786,0.5324242,0.99850136,-0.2686181,0.7974398,-0.34874722,-0.5124327,-0.18399952,0.35012746,-0.4874761,-0.44954577,0.9007719,-0.99957645,-0.6292245,0.5567993,-0.19463208,-0.88743824,-0.04967702,-0.4803268,-0.4485684,-0.33804426,-0.22920251,0.42792293,0.49825633,-0.21319008,0.57507455,0.81364846,-0.4253582,0.036243223,0.3013012,-0.7740363,0.50271326,-0.62590873,0.43026504,-0.25681558,-0.47815788,-0.023814341,0.9997839,0.32349783,0.18294652,0.40496567,0.19986631,-0.49566627,-0.97418624,0.3755941,0.4909015,-0.43829006,-0.6020338,-0.9999986,-0.47889745,0.20920938,0.27806434,0.7236616,-0.002018821,-0.3661112,0.17372221,-0.9973898,-0.21753989,-0.074692085,0.064610854,-0.38939264,0.7505331,-0.59986407,0.05988134,-0.37385958,-0.97433424,-0.87613714,-0.68813455,0.3057964,0.5976078,-0.56918836,-0.6607346,-0.38898933,0.5636769,-0.7145208,0.3129396,-0.5937753,-0.6653274,-0.018242754,-0.4047243,0.11666684,-0.19113089,0.42560384,-0.85228914,-0.6773887,-0.20212583,-0.7045497,0.6155518,-0.7647446,-0.90249246,-0.62094176,0.21325016,0.7976128,-0.6669476,0.29083028,-0.033478446,0.02266937,-0.12360209,-0.15017232,0.436029,0.11166014,0.6582026,-0.3951374,0.5703599,0.652588,-0.3330583,0.5014494,-0.5037967,-0.033963688,-0.09080531,-0.5899382,0.017002681,0.26881552,-0.10141908,0.6762452,-0.030988945,0.3403432,-0.9997881,-0.17174777,0.4459504,-0.30867618,0.41784343,-0.6305548,0.25300497,0.5675957,0.33842152,0.003425014,-0.36563507,-0.101495154,-0.06089494,-0.4805635,-0.7218568,0.95667636,0.033503335,0.17348105,-0.20241866,-0.06532255,0.48925576,0.20613037,0.41228232,0.23090571,-0.38197595,0.27852607,-0.36510962,-0.22158277,-0.15579137,-0.42675042,0.36592343,0.85094064,-0.490665,0.19272628,0.41327763,0.73643136,0.5443056,0.7251989,0.5878942,0.18236879,0.33982787,-0.1612085,-0.7877331,0.03326242,0.3923027,0.5297211,-0.058770575,-0.2810181,0.3258425,0.36506358,0.08185437,0.7982094,0.15725283,0.22030756,-0.5364908,0.399678,-0.32444945,0.6166808,0.658833,0.86874115,0.35230106,0.19951646,0.9957386,0.39463285,0.18984045,0.003098224,0.79144496,0.19498996,-0.29345256,-0.86913776,0.25835308,0.055960737,0.9322814,0.58965087,0.22789627,-0.16113687,0.6146933,-0.15430766,0.85689306,-0.088089176,-0.3104665,-0.08065791,-0.4566611,-0.07711386,0.6215098,-0.01922725,-0.23215516,0.9999989,-0.99484307,-0.7457851,0.101714745,-0.12675942,-0.20154674,-0.7047015,0.08122742,0.33903906,-0.3788624,-0.9993514,0.38343182,0.8327974,0.17545958,-0.043348588,0.4762444,-0.019553592,0.29826024,0.17221846,0.2584632,-0.3495199,0.15948975,-0.937275,-0.250159,-0.010885255,0.4767365,-0.38825548,-0.6810746,0.06472521,0.4579292,0.6545902,-0.8717619,0.15260857,-0.65496796,-0.28929263,-0.75736254,-0.4869077,-0.07600102,-0.2472465,0.7744476,0.18276417,-0.1594672,0.431223,0.43790329,-0.1907268,0.79258573,-0.22700383,0.09010281,0.21276015,-0.78885984,0.027319053,-0.22036694,-0.7194071,-0.97630423,-0.15534881,0.09100173,-0.13867624,0.23248754,-0.15363468,0.30818236,0.30312723,0.9994822,-0.13648014,0.2275707,0.604726,-0.11630419,-0.004043806,0.24769258,-0.8852188,0.32907587,-0.33828455,-0.49895006,-0.51107967,-0.10242505,-0.19276755,0.36253706,0.3423781,-0.5762138,0.67161155,-0.9968632,-0.610617,-0.5832238,-0.35428056,0.4582333,0.3890446,0.01584914,-0.39423206,0.27467063,-0.76108015,0.6615819,0.60242766,0.1942278,-0.22409984,0.6658355,-0.6653482,0.2992617,0.15162438,0.5199991,0.098070756,-0.014318288,-0.21860372,-0.6636832,0.18657084,-0.40123522,0.90320575,0.2622943,-0.55796844,0.3203871,0.28615564,-0.6434266,0.4521043,-0.37705407,0.31829372,0.18096513,-0.05347534,-0.2417745,0.4220976,0.60163736,0.7125669,-0.4043842,0.99986494,0.21465707,-0.9859178,-0.20935293,0.99860513,-0.81966376,0.48809582,-0.99767375,0.5770082,-0.77130663,0.1562308,0.18847667,-0.09142056,0.119993046,-0.19143967,-0.6750189,0.58231944,0.31750298,-0.3809953,0.5067527,0.15116331,-0.34260643,-0.9998867,0.9999999,0.7261819,-0.25079525,-0.25766334,-0.65612847,-0.085834265,-0.41138527,-0.4393676,-0.48238537,0.052763697,0.304793,-0.9130653,-0.41959015,-0.13943161,-0.011642874,0.86322737,-0.21176441,0.27570832,0.9832557,-0.9974703,0.2744634,0.28061804,0.076704055,-0.052112635,-0.26094106,-0.7269436,0.5072096,-0.10090919,-0.34364936,0.034689344,-0.17738076,-0.49638912,0.98231965,0.5811496,0.4168274,0.09833498,-0.30042708,0.36138988,-0.19287936,0.13547078,-0.5610679,0.30356258,0.005961807,-0.71244615,0.26855668,0.551158,-0.35788146,-0.15438597,0.20954224,-0.6113846,0.6995172,-0.6055274,-0.16598353,0.21095943,0.99954605,-0.7798696,0.36544496,-0.53547513,0.29378352,0.6800168,0.9982981,0.83945125,0.23136504,0.043440983,-0.4721075,-0.5907267,0.55306923,-0.9984172,-0.15482166,0.08564564,-0.18382162,0.087261446,-0.21295509],
    [82,1,"O=[N+]([O-])c1ccc(O)cc1",-0.44745517,-0.29982615,-0.21758142,0.5301039,-0.28815064,-0.1451776,-0.5639944,-0.08111947,0.41070166,0.29375434,-0.06157992,-0.019663088,-0.16969952,-0.32853174,0.12751672,0.24742323,-0.07067262,0.5027402,0.23661251,0.47584072,0.6355195,-0.80371183,0.31083813,0.29992276,-0.32445946,0.4528931,0.40743986,0.2544804,0.23145135,-0.624772,0.0760433,0.28286514,-0.10675484,0.44245243,0.31495452,0.20501979,0.22938426,0.7187566,-0.42122245,-0.9074665,-0.99858224,-0.017205795,-0.0653845,-0.22644383,-0.13068059,-0.9980081,0.41641712,-0.2888222,0.99060714,-0.16833588,0.50707364,0.02416813,-0.39032885,0.17275245,-0.9302127,-0.08214103,-0.65039396,0.96618116,0.032349844,0.54872644,-0.6168242,-0.54855335,0.07645767,-0.4306937,-0.20226431,0.6959738,0.6683354,0.59436315,-0.44968057,0.25911143,0.697058,-0.99823385,0.27562597,0.2584309,0.11072673,0.64184254,0.025551472,-0.18366559,0.2556482,-0.99800533,-0.42105764,-0.4179356,-0.8090896,-0.7406244,0.27532232,0.7574607,0.10213118,-0.40667215,-0.79187906,-0.310381,-0.03341498,0.07877249,-0.61602163,-0.13212077,0.9497726,-0.002755352,-0.33706224,-0.21450031,0.14436977,-0.2668434,0.5192613,-0.6344723,-0.07219302,-0.44666207,0.9620894,-0.54659283,-0.074929655,0.5335217,-0.8949331,0.24797577,-0.4363785,-0.56262684,-0.52812064,0.028671931,0.33072215,0.09601063,0.6627969,0.07876147,0.9997333,-0.3060728,0.01543051,0.15429543,-0.48910818,-0.051507946,-0.6442822,-0.13705157,-0.20828262,-0.12889634,-0.12833627,0.99110293,0.31470793,0.36558053,-0.2513684,-0.2482728,-0.7017531,-0.30867654,0.5490363,0.14002621,-0.48516166,-0.19751577,-0.99804145,-0.06773397,0.93761086,0.24999537,0.43649337,-0.15561092,0.051561095,-0.280773,0.9980622,-0.2905029,0.165876,-0.4799543,-0.3880641,-0.123661384,-0.2939003,-0.50862986,0.15468113,0.9996169,-0.16759816,-0.69089735,-0.9965152,0.11782078,-0.28237492,0.07192721,-0.3066934,0.47013456,-0.33335587,0.476864,-0.5470828,-0.325279,-0.55040336,-0.095916785,0.21616231,-0.18479148,0.11921755,-0.97611135,-0.8458777,-0.019016879,-0.44997102,-0.1457407,0.63523006,-0.97757685,-0.33219102,0.2723983,-0.91337454,0.07032668,0.37165132,0.5913863,-0.5497154,0.13478404,0.7360463,0.57004815,0.49886903,-0.39005622,-0.4014278,-0.4794817,0.39509866,0.8330794,0.2961871,0.2821595,-0.6193666,0.060075182,-0.48674706,0.2600263,-0.18619989,-0.42436936,0.5678039,0.3032347,-0.21868205,-0.49138647,0.21090639,-0.13482578,-0.11542738,-0.3426129,0.07513047,0.56231177,0.52853894,-0.29701707,0.14692782,-0.1777178,-0.3222159,-0.060136415,0.329213,0.49115655,0.9977977,0.3989751,-0.2064287,0.61708826,0.15996385,-0.062199656,-0.47867608,0.22805496,0.44963363,-0.24120758,-0.6185581,-0.2783716,-0.43174025,-0.2372204,0.4008363,0.31619486,0.48585597,-0.12188357,0.13554655,-0.3272091,0.3703646,0.30484125,0.16684675,0.11526284,-0.47940236,-0.33982491,-0.22422662,-0.9975555,0.05383718,0.38139558,0.43251786,-0.26105836,-0.35768285,0.2892809,0.43890926,0.29869458,-0.7604142,0.5389737,0.36398333,0.11019166,0.47717506,0.15114266,0.39970797,0.7987719,-0.6063601,0.12161347,-0.13556111,-0.9082834,0.6374284,0.30500042,-0.3958132,0.9024612,0.046253804,0.083540626,-0.36130026,0.08977691,0.30757642,0.9997144,-0.49544305,0.71987444,-0.06283681,0.099151276,-0.26385972,-0.7372103,0.6234078,0.21875453,0.58857524,0.99982655,0.50917894,0.6134433,0.030827394,0.6783188,0.99916726,-0.546381,-0.053933725,0.28045103,0.0297077,0.42567095,-0.4351814,0.31687656,0.19415049,0.026132816,0.9990918,0.037969224,-0.50276977,0.0889154,-0.34527135,-0.109113224,0.120203175,-0.003862573,-0.5550866,-0.16885777,0.31153655,-0.12962006,-0.9863105,0.30939662,0.31622887,-0.023238286,0.37460384,-0.7538617,-0.34793276,-0.34404498,0.11898041,-0.8923064,-0.52187103,-0.2309359,-0.10280062,-0.22633366,-0.3469017,-0.5735373,0.23545186,-0.7871601,-0.25003952,-0.28864408,-0.60086274,0.07633134,0.5139893,0.0916622,-0.47927818,0.77509624,0.3803666,0.07865696,0.36978808,-0.6288588,-0.5470591,0.9619364,-0.99724865,-0.05715219,-0.63270944,-0.18037273,-0.07612542,0.041778725,0.20484455,0.98647124,-0.3601432,0.23943177,0.2952406,0.44836122,0.18813576,-0.0857261,-0.39359522,-0.006599838,-0.3334187,-0.6022069,0.03707412,0.63461393,-0.17035699,0.40937886,0.31118697,0.968663,0.6369965,1,0.30171695,-0.56585276,-0.40508834,-0.5341573,-0.92960674,-0.63495713,0.19620255,-0.78265405,0.34260342,-0.48983476,0.41216996,-0.5892033,-0.15310678,0.75237787,-0.31123084,-0.072611324,0.07938969,0.39604685,-0.45689258,-0.2983752,0.3830196,0.66658837,0.8046837,0.6136836,-0.44117102,0.063024916,-0.38517433,0.046491344,-0.16066162,0.3694031,-0.51699644,0.99079883,-0.6352553,-0.07484991,0.6355621,0.4120635,-0.29194212,0.10029208,0.7009088,-0.38632032,0.9999778,0.2335742,-0.99485594,-0.402379,0.9977013,-0.48770532,-0.13183884,-0.9968977,-0.3831387,0.5958256,0.56879103,0.3242908,-0.83579236,0.1677911,-0.14440836,0.7822333,-0.1523937,-0.60072917,-0.117026545,0.09784572,-0.2996262,-0.09779356,-0.9999766,-0.9995455,-0.99702126,0.64036655,-0.17313279,0.2811821,-0.30424124,-0.16248204,-0.8101478,-0.18485278,-0.07554194,-0.328536,-0.8221167,-0.1499891,0.41126207,-0.35256395,0.475017,-0.3314202,0.03672742,-0.9952977,-0.999972,-0.38571855,0.12546489,-0.14620247,-0.25663218,0.019927552,-0.78535867,0.45417017,-0.5873437,-0.3027549,-0.38128176,0.15759249,-0.18248132,0.91594595,0.09675019,0.90907556,0.12941071,0.5787289,-0.011085807,-0.43249565,-0.525572,-0.25938454,-0.35218024,0.7709429,-0.291553,-0.5316605,-0.381632,-0.22042906,-0.5042393,-0.6886425,-0.0230232,0.33494204,-0.46109727,0.000647761,0.18835777,-0.95829934,0.20115589,-0.011995372,-0.7228111,0.34123147,0.13440609,0.9989907,0.45366588,-0.3340211,-0.35288814,0.31851053,-0.3920065,-0.1695637,0.82491404,-0.07877832,-0.44218603,-0.6712316,0.6869893,-0.029175213],
    [83,1,"CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(C)C)cc2)cc1",-0.25809857,-0.44093138,0.64369035,-0.7964948,0.3048616,-0.4875632,0.4534445,-0.6610062,-0.48308882,0.036171913,-0.78667456,-0.11979875,-0.17747128,-0.60830545,0.26245427,0.6683676,-0.52317226,0.36350918,-0.30561665,0.55601627,-0.81629246,-0.17977561,-0.20549755,-0.7041782,0.5160269,-0.38975078,-0.49995467,0.080758855,0.47431615,-0.35100216,-0.030249046,-0.46984187,-0.073003426,0.5325001,-0.73919773,0.89539415,-0.68217176,0.607791,0.99982035,-0.5280487,-0.13257267,0.03572676,0.46811458,-0.61024094,0.07196273,0.62191427,-0.109232605,-0.5129715,0.9995351,-0.15991834,-0.61997026,-0.79566884,-0.37193987,-0.13440447,-0.87462056,-0.5629287,-0.6667218,-0.9320545,-0.84970456,0.35459843,0.053116266,-0.6334728,-0.20312592,-0.80050015,0.34728116,-0.3247886,-0.41767672,0.5883431,0.7396084,0.60272676,0.9725664,-0.21489662,0.8757255,0.23974416,0.8824812,-0.5887338,-0.3799833,-0.25792742,-0.38409314,-0.9960624,0.49183896,0.5423569,-0.84566015,-0.4878957,0.041838408,-0.88509756,0.31251082,-0.58832777,0.15728262,0.2972201,0.8879503,-0.38804913,0.668055,-0.5605857,0.911139,-0.46463785,0.4316449,-0.33689383,0.20153713,-0.5318116,-0.14650542,0.82135016,-0.35163862,0.8532937,-0.999794,0.8484154,-0.4068905,0.58039856,0.98859364,-0.8417745,-0.29860672,0.30272636,0.36345154,-0.59358543,-0.31597117,0.6327468,-0.6809292,0.51277983,0.9032932,0.22680505,-0.31783226,-0.4976054,-0.016008092,-0.41333255,-0.1408811,-0.3421471,0.23738596,-0.19791405,0.23027666,0.99991035,0.003820277,0.6369177,0.29227686,0.29351816,0.19685592,-0.9750601,0.23026454,0.65681934,-0.8487706,-0.724471,-0.99998856,0.68711394,0.8643919,0.09896359,0.6892403,0.15610345,-0.22297879,-0.14099398,-0.99918926,0.33724853,-0.38194153,-0.969114,0.46992537,-0.06479188,0.25796008,0.32075498,-0.000655264,-0.9576298,-0.74538875,-0.98274165,0.100243576,0.8674375,-0.3165683,-0.38988572,0.31935233,-0.7219467,-0.055891,0.36417454,-0.058170427,-0.2932804,-0.6150185,-0.27482316,0.15397169,0.39859882,-0.75123024,-0.88697183,0.03648143,-0.8275903,0.15043734,-0.47819608,-0.18848188,0.80396754,-0.33327696,0.02844955,0.88759345,-0.7381343,-0.06067026,-0.010235565,0.64366347,-0.122834526,-0.18172853,-0.7360613,-0.77444303,0.33688092,0.805701,0.3842617,0.029241197,-0.7407014,0.8260973,-0.65314656,-0.6226721,-0.820418,-0.7920868,-0.6964967,0.02302572,0.64078707,-0.55803996,-0.74083793,0.082952686,-0.99993855,0.11577509,-0.38991848,0.1658554,0.8243495,0.35894924,0.6589978,0.72727656,0.3427973,0.54901576,0.6400316,0.6174855,-0.45865166,-0.9474324,-0.5904729,-0.9928661,0.26344073,0.15222466,0.20796436,-0.07547645,0.3909437,0.50101745,0.13777928,0.36456922,0.43768993,0.19535999,-0.31150702,-0.08986727,-0.4632764,-0.15193379,-0.39570484,-0.92164546,-0.42524675,0.367746,0.048587102,-0.27980563,-0.44916752,0.21382038,-0.20237586,-0.20221733,-0.09388736,-0.124176376,-0.8515716,-0.5897539,-0.41534647,0.8568239,0.19339398,-0.69054806,0.26723573,0.008019446,-0.3555855,-0.14120021,0.16383694,-0.48859572,-0.20565894,0.11110855,-0.6413478,-0.17063457,-0.08011827,0.9845225,0.8559901,-0.13010627,0.9998567,0.20414765,-0.10814429,-0.50891256,-0.9140359,0.70660734,-0.74633646,-0.6565955,-0.32020706,-0.37799785,0.9760147,0.53860116,-0.5899644,0.7117155,0.4121282,-0.5553547,0.9820561,0.5395722,-0.21721473,0.6777875,-0.20100665,0.43717554,0.8090773,0.5430425,-0.6702299,0.9999949,-0.9975441,0.34335575,-0.26313204,-0.2123785,-0.28447735,-0.20414607,-0.5374764,-0.35220018,-0.98834944,-0.9963743,-0.029456625,0.7464479,-0.21656367,-0.7356603,0.8025035,0.33559832,-0.7375369,0.94879675,-0.62577385,0.5707233,-0.096405685,-0.99993813,-0.63949895,-0.25508907,-0.48554134,0.7782866,0.6367294,-0.47534624,-0.057714846,0.0248511,-0.58559144,0.35839108,0.12986116,-0.09254018,-0.81761914,0.75182027,0.5488381,-0.6647332,0.94974923,-0.8628874,0.3125612,-0.77325183,0.65088314,0.29350513,0.08390715,-0.31856754,-0.48866993,-0.3759823,0.41445455,-0.2061662,-0.51370233,-0.3457035,-0.96461874,-0.49942622,0.25595012,-0.18583041,-0.59050465,-0.16325328,-0.50575733,0.4182801,0.99948364,-0.29258305,-0.4175932,0.49970862,-0.33836895,-0.819594,-0.014422953,-0.92738837,-0.50492716,0.14902054,0.33678615,-0.86236435,0.4376426,0.25834867,0.5606115,0.6879626,-0.6932287,0.24096553,-0.9812497,-0.30603814,-0.5510925,0.063120075,0.17824471,-0.5071483,0.1285759,-0.71038043,-0.7732895,-0.8117465,0.02521991,0.016720919,-0.4740606,0.19173634,0.23325866,0.42542002,0.60093683,0.6223164,-0.5841094,-0.2202796,-0.6501077,-0.29862422,-0.72849286,0.842825,-0.81440556,-0.24196841,-0.19300094,-0.31071317,0.32437274,-0.14986297,-0.9147086,-0.80758244,-0.72342116,-0.16006427,-0.015712285,0.74494725,0.04437636,-0.019432295,0.38863152,-0.9371446,0.7530439,0.99999994,0.66404086,-0.98224175,0.86445653,0.9995884,0.054170348,0.23018947,-0.9999649,0.46765095,-0.57527184,0.69830674,-0.67664975,-0.4074859,0.23195875,-0.33360505,-0.53796273,-0.80482775,-0.31425884,0.008399648,0.19852991,0.8620919,0.69977117,-0.9999603,0.99999774,0.510079,-0.65481395,-0.24793102,-0.31266582,0.27645478,-0.8420466,-0.6793357,0.8190061,0.18592098,-0.08986771,-0.81292385,0.68391824,0.48152754,-0.494849,0.6109476,-0.19798951,-0.4847752,0.9657943,-0.9993413,0.8408123,0.36698845,-0.06406932,-0.18882507,0.3767592,-0.9882156,-0.6074815,-0.053690095,0.65454376,-0.47367585,0.40658394,-0.78399956,0.9407916,0.002836926,-0.68280673,0.6906286,0.58885473,0.40684503,-0.5500938,-0.33712867,-0.09674524,0.57610536,-0.6048947,-0.99997216,0.30038783,0.8610781,-0.48373693,-0.20287158,0.17153493,0.34617358,0.088834465,0.65072525,-0.44465473,0.07696571,0.99891067,0.5805535,-0.28433767,0.34277806,-0.4653488,0.531936,0.9968069,0.8131641,-0.15486032,-0.07024986,0.100303315,-0.48640934,-0.103271134,-0.9994837,0.42160892,0.44084647,0.17894742,0.20054844,0.02861316],
    [84,0,"CC12CCC(=O)C=C1CCC1C2CCC2(C)C1CCC2(C)O",-0.12407378,0.19953652,-0.10388287,0.6516371,0.38360912,-0.21379012,0.07668224,0.23794033,-0.004995162,0.11005555,-0.40513197,0.07183472,-0.005476461,0.6784195,-0.6269405,0.3145615,-0.34623533,-0.20929487,0.52701145,-0.21190804,-0.13770226,-0.27145365,-0.2672425,0.011292523,-0.38217628,0.59818536,0.5044993,-0.20654377,0.48870972,-0.3564809,-0.162421,0.5885534,0.66113955,0.36957258,-0.11926364,0.0994728,0.44077834,-0.059221435,0.99898106,-0.36138177,-0.7667953,-0.31996062,0.07686264,-0.3710745,0.06662276,-0.44393072,0.58983284,-0.48863217,0.9799213,-0.5824751,-0.12122652,0.3430884,-0.5332802,0.42277944,-0.850905,0.098791994,0.17860276,-0.17721355,0.43331715,-0.28051072,-0.09871135,-0.101154126,0.6150941,0.11566851,0.6843545,0.48975256,-0.22059424,-0.46067515,0.34711838,0.85968715,0.2594846,-0.66390747,-0.3006986,0.8667252,0.3046483,0.829713,-0.2640732,0.3728647,0.35423318,-0.99982786,-0.7093648,0.49181372,-0.300418,-0.25372425,0.41169944,-0.88206166,0.4504212,-0.38186607,-0.1149089,-0.1609485,0.07547305,0.32928655,0.38354692,0.09115056,0.9911212,-0.5720244,0.77574277,0.09925025,0.1747003,-0.56848353,0.17352565,0.5758781,-0.22083151,0.8825046,-0.9957057,0.6720712,-0.6965335,0.4903594,-0.7054957,0.044017926,-0.64001435,0.0802299,-0.031965148,-0.52091813,0.5315931,0.12577704,0.07015479,0.14143929,0.9812098,0.42052522,0.205842,-0.12235676,-0.45888385,-0.02250331,0.26240945,-0.084960684,0.004905488,-0.39049143,-0.34354118,0.9998233,0.12231255,0.4463921,0.5245846,0.20826939,0.3230218,-0.83920467,0.6001212,0.37070608,0.39735433,-0.70393664,-0.99914217,0.4141308,0.8415253,-0.020788522,-0.5461802,-0.2149759,-0.23720722,0.065020464,-0.93928605,0.67045814,0.5148839,-0.8652695,0.8333333,0.27204677,0.4512941,-0.14469633,-0.56940776,-0.27544954,-0.77464044,-0.85030645,-0.820136,-0.23552693,0.61223286,-0.1430673,0.59792835,-0.40720242,0.22293955,-0.3026837,-0.5811256,0.6079353,-0.24742731,-0.42094103,0.0481237,-0.46876428,-0.5612955,-0.9902354,0.7606334,0.7715505,0.624685,-0.4642222,0.3260078,-0.60791713,0.35133418,0.1872618,0.40365383,0.04621553,-0.5490824,-0.24281089,0.26509684,0.08024236,-0.9133495,0.065575734,-0.39230523,0.04110267,0.4862432,0.5864278,0.003236686,-0.69970244,0.088367775,-0.20363422,-0.13690566,-0.18105377,0.006096935,-0.5804358,-0.26130033,0.3008113,-0.37778497,-0.7067169,0.3045145,-0.9999446,-0.62303555,0.37484324,-0.48913026,-0.6400537,0.117719404,-0.3519615,0.14436808,0.7208585,-0.20196679,0.30844757,-0.5443073,0.15400718,-0.77318054,-0.7272328,0.9892178,0.7409347,-0.07923957,-0.54318285,-0.33474177,0.7257445,0.4827016,-0.66757745,-0.39723203,-0.66216016,0.04443867,0.24943274,-0.25723985,0.27800825,0.28282732,-0.06180146,0.89704037,0.25884435,0.7112079,-0.5022886,-0.88864183,0.054835103,0.19200887,-0.14164671,-0.18174113,-0.63527197,-0.42394027,-0.64042336,0.059570566,-0.2876593,0.2017832,-0.4908558,-0.39474526,0.094462626,-0.7278194,0.12214098,-0.72391355,0.31565845,-0.5027505,-0.2323239,0.375387,0.18153608,0.3091707,-0.64542377,0.44876984,-0.020445036,-0.43111596,0.9966638,-0.18365769,0.038618676,0.30033126,0.52053607,0.31357276,-0.82056946,0.36678502,-0.8016421,-0.005078765,0.99625754,-0.7960913,0.4559682,0.0735878,0.109702006,-0.4309337,0.8471813,-0.3330641,-0.045515236,-0.75354755,0.86545813,-0.64413387,0.1686991,0.7274778,0.7298668,0.99999505,-0.9936492,0.89791304,-0.4241654,-0.4380198,-0.3837144,-0.17359936,-0.60653317,-0.8816757,-0.9925262,-0.95771515,0.3674492,-0.5572134,0.275941,0.1004186,-0.49170092,0.23026867,-0.5248104,0.5296836,0.4360921,-0.13788383,0.051782787,-0.9875838,0.64809096,0.01821179,-0.16418524,0.6670063,-0.45733684,-0.56803405,0.4040564,0.08896413,-0.6808638,-0.6582731,0.17997314,0.2688563,-0.42888057,0.7160146,-0.117421106,0.15957804,0.73414123,0.030469114,0.56765115,0.69706744,0.06659913,0.45991188,0.038136683,0.91217005,-0.4135002,-0.059961975,0.8300935,0.06761637,-0.6518623,-0.06344387,-0.80192924,-0.9347694,0.483422,-0.08574355,-0.3194147,0.15219244,0.5697632,0.11992522,0.99918413,-0.79560107,0.07815581,0.33703992,-0.019165048,-0.090724714,0.7834262,-0.8696409,-0.042674515,0.58705825,0.65400463,0.30279878,-0.09988135,-0.47471026,-0.82994443,0.5697333,0.2608746,-0.33786637,-0.999912,0.48803475,0.30546343,0.61784774,-0.35505465,-0.6759977,-0.11552342,-0.024115361,0.3691943,-0.16415864,-0.43615085,-0.3177356,-0.52424926,0.0545285,-0.8737853,0.5596465,-0.37768766,-0.5997757,-0.016104674,0.30022636,0.28582007,0.3279026,-0.09148301,0.6728076,0.13813145,0.3412329,0.74638283,-0.65153086,-0.24442814,-0.01590253,-0.398319,-0.33444083,-0.7226662,-0.05238127,0.03707587,-0.063858114,-0.48575628,-0.001759027,-0.10198805,-0.34090653,0.38101444,0.9999559,0.000504166,-0.9787555,-0.42330533,0.9902582,0.25591743,0.12333627,-0.9995647,0.7364462,-0.28940907,-0.20437324,-0.41559207,0.60017025,-0.44635248,-0.8029301,-0.8349209,-0.27744645,0.1589053,0.5262131,0.44916168,-0.012551198,-0.25057682,-0.9999469,1,-0.14732581,-0.43925548,0.37754202,0.96647507,-0.36334783,-0.38405252,0.8401374,0.45252427,0.1646977,-0.2656132,0.21701036,-0.49368924,0.68523955,0.25351137,0.38619322,-0.1448401,-0.25371364,0.6128368,-0.999774,-0.49358284,-0.35613012,0.48497233,-0.007220135,0.578557,-0.944572,-0.10069712,-0.5657827,0.49637493,-0.34490177,0.634832,-0.21167232,-0.062088575,0.1604831,0.80388147,0.6660152,0.36241812,0.38514894,0.14066212,0.36107594,0.39025468,-0.485227,-0.5030782,-0.9817999,0.31218082,-0.010523294,0.70160496,-0.5778418,-0.29567,-0.22218351,-0.9807098,-0.36412698,-0.4617708,-0.16724612,0.99627954,-0.06854408,-0.29519147,-0.7439424,0.5140203,0.4147114,0.99948984,-0.31840077,-0.44097412,-0.20472786,0.14253578,-0.5396934,-0.29267755,-0.9987605,0.6508911,0.029200563,0.07713904,0.82172203,0.016102456],
    [85,1,"O=C(N=c1cc[nH]c(Cl)c1)Nc1ccccc1",-0.78355974,-0.11983552,-0.2886985,0.6473692,0.072934054,-0.36162,0.009762678,-0.11472802,0.1523045,0.25244877,-0.69540536,-0.11956314,-0.29463214,-0.65836376,0.7708548,-0.32865712,0.5048836,0.23281103,0.65871054,0.59644806,0.7200687,-0.7305332,-0.34252167,-0.1421422,-0.14241873,0.38220933,-0.35939953,0.20230304,0.38557547,-0.28836474,0.062112436,0.50436765,-0.43499607,-0.16890925,0.07683191,-0.09225798,0.38528782,0.10612493,0.96406645,-0.81264275,-0.95664155,0.3040552,0.10011577,-0.31411493,0.6346125,-0.96854335,0.15314247,0.77018523,0.8415266,0.47819477,0.37177348,-0.1705885,0.6094447,-0.50137335,-0.723811,0.09655612,-0.76615053,0.801258,-0.17918459,0.27483872,0.6032002,0.032819428,0.26074785,0.57096994,-0.59406674,-0.4914335,-0.16356847,0.40413898,0.4608463,-0.39815718,-0.7645962,-0.9693791,0.5137117,-0.19687559,0.5348718,-0.64024836,0.28043067,-0.7582997,0.1741359,-0.9978826,-0.87704146,-0.1857664,-0.5367879,0.23774467,-0.32136354,-0.48122755,0.5219692,-0.42644784,-0.40452194,-0.038407058,0.26020545,-0.22652352,-0.11462056,0.13420989,0.98821056,0.13610508,-0.4272824,0.73532313,-0.2830062,-0.11101533,0.021308761,0.43713468,0.6974905,0.9596144,-0.46049637,0.34587106,0.032018054,0.16409051,-0.99990606,-0.54037654,-0.22099851,-0.1774389,-0.532319,0.058295928,-0.42841774,0.04273464,-0.20567027,0.5094358,0.9987862,-0.56162614,0.46105132,0.13091144,0.42395517,0.22900371,-0.23116204,-0.44474065,-0.21416588,-0.1763962,-0.026629811,0.9995551,0.27427727,0.30890518,0.51234925,-0.27282384,0.027116532,-0.9616903,0.6081582,0.7564577,-0.69574046,-0.11550548,-0.9999649,-0.15329155,0.93207425,-0.43516183,0.54456186,-0.5156377,0.17902611,-0.23153737,0.6692831,-0.22389004,-0.51229376,0.92926055,0.51462215,0.49542794,0.17769702,0.41418457,-0.5457709,0.9826189,0.066439435,0.8388836,-0.9741858,0.4094985,0.015187555,0.6225408,0.35545695,-0.34665126,-0.3140778,-0.39967114,-0.6141211,0.21106833,0.036835164,-0.2096014,0.5786272,0.68011653,0.3785133,-0.87784946,-0.66863096,0.23370786,0.6998872,-0.36819106,0.7490281,-0.43299815,0.006944634,-0.23319553,-0.66601723,-0.23903444,0.24390015,-0.42938513,-0.008546604,0.17607366,-0.07867318,0.005967535,0.4771847,0.09258358,-0.049121402,-0.36834195,0.77992195,-0.5418901,0.79239875,-0.38923785,-0.09459412,-0.5102068,-0.6426545,-0.23284891,-0.51392597,-0.23638006,-0.006074948,-0.089976445,0.13356423,-0.99792415,0.46394417,0.28951937,0.2657045,0.595556,-0.32771397,0.2350485,-0.21244961,-0.16885054,-0.5886093,0.4712543,0.49943215,0.46425712,-0.711517,0.16273141,-0.9054167,0.53326523,0.41587517,-0.1301559,-0.30580747,0.4140162,-0.7062371,-0.5919853,-0.22535314,-0.75153506,0.16312365,-0.79092604,0.22483525,0.44890764,-0.39771417,0.25574872,-0.978644,0.12674285,0.32986307,-0.77794373,0.510198,-0.33056208,0.22110046,-0.5544287,-0.47705004,-0.7424318,0.904982,-0.97137237,0.4354837,-0.21702102,0.75756717,0.5666904,0.14439003,0.51151645,0.06484985,0.64242446,-0.001155715,0.723645,-0.26249075,0.25177118,0.66528755,-0.15713853,0.5103972,0.0110041,-0.31486493,-0.688045,-0.62443894,0.95694226,0.5327533,-0.07774877,0.18835269,0.7599308,0.21868475,0.45196393,0.05442868,0.21417752,-0.17634682,0.9996886,0.30715686,0.4577708,0.70953715,0.46273768,-0.33696443,-0.8333767,-0.9871622,-0.2785396,-0.010566645,0.9978473,0.17523508,-0.46993187,-0.14202067,0.02509617,0.9999876,-0.97469795,0.12780826,0.5617755,-0.59700507,0.063136704,-0.11852111,-0.65001106,0.5733662,-0.47902957,0.78899914,0.33903554,0.7409759,-0.5560264,0.19028579,0.038739614,0.24415258,0.23127319,0.7572109,-0.71153283,0.34024236,-0.545686,0.9926481,-0.56829244,-0.08648335,0.78708386,0.3464208,-0.41538095,-0.86867404,-0.64137316,0.46607107,-0.9166918,0.11141649,0.006232134,0.27990672,-0.11055391,-0.07566574,-0.66738844,-0.08278944,-0.024282632,-0.21021461,-0.016757311,-0.47222215,0.07191155,0.1666539,0.114085175,-0.44856626,-0.051990233,0.6029914,0.6794627,-0.6442415,0.16341805,-0.033874318,-0.12452836,-0.99445784,0.04780684,-0.24622558,-0.2824167,-0.13502465,-0.085338995,0.17443843,0.9997782,-0.29009575,-0.43734485,-0.3686201,0.17904721,0.44178513,-0.41625783,-0.8295645,0.6561099,0.5555057,-0.08014739,-0.36244485,0.8894138,-0.61018723,0.2543479,-0.04158825,0.53094393,-0.2203212,0.9972473,-0.30813333,-0.099571794,-0.36927953,-0.003982981,-0.772251,-0.4235942,-0.037067357,-0.5815377,0.16047321,0.3372493,-0.11074103,-0.022872036,0.20201254,0.5069699,0.11405459,0.36954153,-0.65555084,0.07911137,0.12285024,-0.3118947,-0.17628606,0.33717158,-0.23180407,0.38454792,-0.13900296,-0.46420246,-0.07177989,0.09042842,-0.5715243,-0.024047058,-0.14947698,-0.66953933,0.5546958,-0.24371517,0.6818243,0.55706894,-0.3187164,-0.29458746,-0.043195713,0.51737344,0.6231754,0.4597406,-0.9757647,0.40285337,0.9997526,-0.33891645,-0.12165687,-0.9554619,-0.3001064,-0.13970456,-0.049247403,-0.26108488,-0.16466151,0.1339898,-0.16486435,-0.010128378,0.24610388,0.19413325,-0.2429295,0.16941762,0.49825236,0.5926397,-0.99999386,0.9819416,-0.93971467,-0.5366236,0.35901332,0.02091555,-0.85592884,-0.5232572,-0.7710049,0.101115786,0.43464798,-0.54763275,-0.76851654,0.7300092,0.17261443,0.68526715,0.42837337,-0.64572084,-0.09603262,-0.88853574,-0.99996597,-0.5393681,-0.09831889,0.20957276,-0.5799236,0.1694125,-0.9667447,-0.30532444,0.50028765,-0.48120153,-0.5761034,-0.0906513,0.22524826,0.9529618,0.15422496,0.8157126,-0.02396859,0.1621501,0.28916842,-0.70686144,-0.25754598,-0.4782031,-0.60592794,-0.36248347,-0.923314,-0.42827803,0.042762525,-0.6736934,-0.12453044,-0.10638227,0.49646646,0.4032127,0.47910058,-0.45400822,-0.11585186,0.6783713,-0.7818779,-0.29315922,-0.62784743,-0.34456974,-0.0850224,0.9997618,0.109045416,-0.04356448,0.3456145,-0.006790291,-0.5303434,-0.6082575,-0.89813364,0.6094823,-0.4530633,-0.27523318,-0.2721249,-0.14706464],
    [86,0,"N#Cc1ccc(N(CC(N)=O)CC(F)(F)F)cc1C(F)(F)F",-0.80728686,-0.17742535,-0.1255961,-0.8282476,-0.31868947,-0.21350864,0.20149934,-0.24175464,0.7063572,0.23030159,0.6144209,0.37063116,-0.18140675,0.93910676,0.5688221,-0.7269383,-0.32943904,0.17163156,0.113341376,-0.7331822,0.38188732,0.34606767,-0.3252988,0.41328987,0.8544969,0.667703,0.16360822,-0.5116909,0.341351,-0.44915387,-0.47983977,-0.1279169,0.38247138,0.30633792,-0.88349223,-0.17992304,0.3030955,0.78052664,0.9968721,0.29493755,-0.8993962,0.0369684,0.24723132,-0.5335048,0.48806387,-0.83066785,0.6220879,0.16977035,0.029036084,-0.51729184,0.037630927,0.19296756,-0.45309195,-0.7600747,-0.32818657,-0.16053808,-0.43851,-0.40999106,0.3183059,0.20565997,-0.61663204,0.88011396,0.35380986,-0.46787512,0.5652974,0.6094722,0.39204058,0.097849414,0.48041245,0.4780906,-0.92107517,-0.9877407,0.3755422,-0.10619743,0.5864695,-0.44874763,0.07206517,0.2485406,-0.7886665,-0.99820155,0.13379315,-0.5829333,-0.9124258,-0.5843853,-0.1758838,-0.42741042,0.18375616,0.619274,0.12420779,0.6715811,0.6169315,-0.21270838,0.60619015,-0.077218436,0.9994719,0.006841463,-0.05166734,0.5341844,0.3468988,0.56961495,-0.016819691,-0.77935094,-0.114591345,0.114985265,-0.96624887,-0.097122185,-0.2657418,-0.46750477,-0.9142971,-0.35679072,-0.41679913,0.38152605,-0.543864,-0.023738483,0.7741534,0.09237609,-0.33225474,-0.16928361,0.9976046,-0.4767613,0.028260639,0.49017307,0.054859407,0.11154478,-0.007269023,0.5468445,-0.6151196,-0.23621795,-0.2794485,0.9976385,0.23210718,0.11069872,0.56973946,-0.62540245,-0.56802547,-0.8104478,0.02170182,-0.109163485,-0.7192461,-0.70895094,-0.9987925,0.06430546,0.7636064,0.2993408,0.8173828,-0.5588666,-0.40405887,-0.30550653,-0.2027145,0.03713181,-0.1319865,0.46603888,-0.4396193,-0.53980917,-0.523711,0.5563219,-0.28106895,0.6344787,-0.62908757,-0.78474903,-0.90126246,0.24375182,0.26819608,-0.49441046,0.31622759,0.6074875,-0.636632,0.07412859,0.22794355,-0.502348,-0.57246834,0.66455644,-0.032911945,-0.28526363,0.37410957,-0.92293245,-0.55550534,-0.29946664,0.027523052,0.43708414,0.11554591,-0.9744492,-0.28835687,-0.6736373,0.26959866,0.010409952,0.7346432,-0.57944375,-0.024637664,-0.803558,-0.011230656,-0.029984223,0.22301751,0.31808782,-0.07109697,0.39684123,0.36615667,-0.2004324,0.5623013,-0.37990662,-0.49430594,0.30405757,-0.81004226,0.16034721,-0.06830854,-0.10154164,0.5110089,-0.22235063,-0.40904874,-0.9997017,0.49746147,0.6108163,0.529195,0.045092676,-0.848273,0.80738217,-0.11767004,-0.56345403,-0.47058293,-0.32010257,-0.009278907,-0.75606644,-0.6996339,-0.6045374,0.998561,-0.38299525,0.42861745,-0.26117274,-0.15347071,-0.6269922,-0.43717343,-0.48512608,0.66663086,-0.7404073,-0.056085806,-0.5794504,-0.31092888,-0.2889805,0.031802688,-0.7781918,0.7000676,-0.13848406,0.6434572,0.2949427,-0.6282831,0.071522325,-0.35216388,0.08763026,0.4842439,0.34137583,-0.34282187,-0.9985429,-0.30546162,0.10339438,0.77196664,-0.05401527,0.32845008,0.18393469,-0.64913356,-0.36195642,-0.4565002,-0.29749694,0.13344344,0.14798653,0.76768756,-0.32905182,0.36839816,0.40533185,0.40910396,0.7205105,-0.1389383,0.91590035,-0.039155282,0.02671094,-0.35530707,0.87890077,0.59147537,-0.68059736,-0.9667701,-0.7649623,-0.21310721,0.99800575,0.325733,-0.44836894,0.57815856,0.5962277,-0.4373583,0.08912175,-0.8481655,-0.35351902,-0.13728005,0.9738363,-0.68881565,0.8424331,0.14056042,-0.6689765,0.997861,-0.9380512,-0.5979627,-0.3424575,-0.194972,-0.1412563,-0.56097704,-0.03552455,-0.023826014,-0.011838165,-0.8061495,0.03205352,0.12089266,0.062725864,0.41277426,0.063956484,0.063595004,-0.3036659,-0.16318256,0.6967403,-0.1984312,0.739249,-0.87116814,-0.3929364,0.6091584,-0.22351219,-0.2772349,-0.0730218,-0.004870287,0.32026628,0.644681,-0.8716593,-0.14351791,-0.76206213,-0.5900181,-0.5725629,0.23061088,0.7379395,-0.2120288,-0.33566195,-0.5614707,-0.43526202,-0.720151,0.5329512,-0.59136665,0.6219259,0.6347002,-0.15935864,-0.07701687,-0.16813706,0.12526721,0.27425727,-0.43506137,-0.4952554,-0.957092,-0.27202746,-0.097199745,-0.39764863,-0.22183733,0.4968849,-0.26789865,0.99992454,-0.73769784,-0.07669424,-0.14264263,-0.58678913,-0.017283933,-0.06783197,-0.36568174,0.31209394,0.42566627,-0.26425353,-0.20093183,0.15722866,0.35140532,-0.004257752,-0.05163569,0.45322433,-0.5044609,1,-0.2157735,0.2641798,0.10707669,0.5571325,-0.04246486,0.2655936,-0.18705817,-0.4541156,-0.27321002,0.59066427,-0.17784236,0.49957424,-0.028631626,0.17371124,-0.4302594,9.3e-05,0.7940838,0.55344,0.045652244,-0.90207875,-0.002488943,0.27185386,0.7814593,-0.054821353,0.63288385,0.30106714,0.16784133,-0.36227238,-0.43686867,-0.32956666,-0.651569,-0.22764076,0.7203417,-0.4506495,0.5467621,0.16460238,0.11977655,0.4065913,-0.037449602,0.36435336,0.99978197,0.61188936,-0.9818465,0.47986925,0.99986595,-0.8998316,0.31978118,-0.9986286,-0.05906171,-0.26406375,0.13290523,0.22015409,-0.35745582,0.053943474,0.2690584,0.23418243,0.24059643,-0.09547008,0.02626826,-0.41234168,0.30397055,-0.35586178,-0.99998146,-0.9964669,-0.8346147,0.13387765,-0.19234672,-0.56478965,-0.7558312,-0.57069933,-0.7084886,-0.6592993,-0.8234968,0.13748579,-0.8307287,-0.038319692,0.28377798,0.22060375,0.18584907,0.16957203,-0.024331793,0.099948846,-0.99992335,0.37088782,0.31832358,0.18133962,-0.66632515,0.25973913,-0.42331466,0.52594644,0.7977496,-0.44924152,0.3634464,0.1529117,-0.45268378,0.9328478,-0.45715258,0.8241274,0.040462337,-0.31458127,-0.27867135,-0.13472416,0.08490316,-0.2891808,-0.54368687,-0.38221502,0.7047843,0.7526488,0.69525295,0.24539576,-0.52422917,0.5635683,0.13802269,0.8321986,-0.025655493,0.4312756,0.46750867,0.97142375,-0.37169436,0.03237285,-0.037883133,0.281236,0.2600596,0.99950564,0.61202925,-0.47514915,-0.21352811,-0.5160237,0.3476049,0.07355698,-0.9901541,-0.24774565,-0.0630852,0.88432544,0.65897197,0.119793266],
    [87,1,"CCOC(=O)c1ccc(C2CCC(NCC(O)COc3ccc(O)c(NS(C)(=O)=O)c3)CC2)cc1",0.044980824,0.59688604,0.24351604,-0.13708961,0.12416911,0.2044356,-0.054036036,0.5217235,-0.39178655,0.56041276,-0.5040488,-0.16437098,0.030505897,-0.029691465,0.8131966,0.3760965,-0.19330959,-0.4471695,0.6180304,-0.84376913,-0.35610405,0.6261646,0.0666073,-0.30748233,0.06168361,0.06606403,-0.50356656,-0.6646643,0.2083381,-0.59325856,-0.42348102,-0.5007435,0.47408822,0.004680882,-0.6904172,0.055755183,0.032866746,0.49628666,0.999833,0.452788,0.9590323,0.34038943,0.55186355,-0.059300665,-0.005100509,0.98867935,-0.053478263,0.0538266,-0.30933028,-0.054519244,0.7089733,0.0675957,0.07981897,0.2141763,0.7679526,-0.23839697,0.38275382,-0.9759823,0.59762824,-0.48651433,-0.29262525,-0.5765209,-0.19340384,-0.3943312,-0.20409404,-0.044114355,-0.28489646,-0.470499,-0.03917512,0.4918695,-0.97853976,-0.9697145,0.5287914,0.16587453,-0.025957532,0.45179752,-0.3565294,0.040157802,-0.32510135,-0.99704105,-0.814604,0.05932388,-0.89504385,-0.41925627,0.08752119,-0.85439837,-0.13184132,-0.08044402,0.14666092,-0.7407891,-0.32528585,0.7696095,0.16562094,0.04829693,0.9998396,0.025598252,-0.5121328,0.21177188,0.49292842,0.095270455,-0.31243616,-0.31099442,-0.2090285,0.9911576,-0.9999373,-0.39354056,-0.4348456,0.3035107,-1,-0.14971177,0.44878674,0.18891115,-0.08767894,0.13664527,-0.10600183,0.26015928,-0.44343308,0.560815,-0.59698975,0.7549658,-0.56606984,0.46109492,0.000592023,0.05747805,-0.6698537,-0.04256492,-0.26936442,-0.28651392,0.17647643,0.995983,0.49879113,0.66960764,-0.06255527,0.3220549,-0.55362236,-0.85988796,-0.4491296,0.7786861,-0.54663867,0.4230122,-0.9999991,0.3123256,-0.88914305,0.60527325,0.49184346,-0.03428082,-0.04638909,0.11692401,-0.99994504,0.6829114,0.7587478,0.79292136,0.89109504,-0.42757183,0.3367658,0.063647814,-0.24548742,-0.9986902,-0.64302003,0.90656143,0.84920365,0.057241175,0.6050298,-0.23133859,0.22237755,0.07005062,-0.6160065,0.12390206,-0.32729697,-0.5207511,0.14683929,-0.12691952,0.3795999,-0.40428674,0.33088094,-0.5978553,0.5678131,-0.38198492,-0.4886976,-0.64584595,0.32357094,-0.99750173,0.19172895,0.43236983,0.97744304,0.6707907,0.84063476,-0.3341049,-0.0975211,0.36038545,-0.12051268,0.8828997,0.24170442,-0.047424316,0.36383373,-0.16099995,0.015304657,-0.024023406,-0.05626135,0.6474515,-0.59776163,-0.5125038,0.24194102,-0.36188835,0.23036444,0.009728771,0.13881022,-0.6642759,-0.1302616,-0.9999006,0.6398526,-0.06920193,-0.15544224,0.2624714,0.059905887,-0.08919612,0.31226888,0.27388215,0.42723605,0.3464976,0.65285325,0.32249147,0.000928815,-0.47848794,0.999908,0.10939386,-0.5023027,0.80698216,-0.5966726,0.2724299,0.078887545,-0.18240213,0.037356336,0.14643574,-0.03820741,-0.629372,-0.6153079,-0.17277163,-0.018140038,0.62700987,0.90026635,0.5590756,0.10031731,0.40112633,-0.13605566,0.146332,-0.1469701,-0.26641825,-0.16933496,0.22576204,-0.6416055,-0.8298302,-0.19094186,0.749883,-0.28911912,0.6835146,0.22475329,-0.42821336,-0.21649823,0.61172205,-0.3232689,0.5242385,0.78763115,-0.56523687,0.56544435,-0.17852364,0.29082707,0.7193639,-0.8342644,-0.13767317,-0.26037535,0.99979204,0.27686962,-0.18669693,-0.553104,-0.7967841,0.6258608,0.6348009,0.46912348,0.43548927,0.41768798,0.041843776,0.06770958,-0.3134389,-0.48528934,-0.5664713,-0.07436694,-0.7005118,-0.99986726,0.20176072,0.8133296,-0.9788522,-0.116505355,-0.6365046,0.3117355,0.89872396,0.9999976,-0.7937347,0.09892689,0.03964323,-0.35418478,-0.5196413,-0.7298647,0.022036016,0.2035481,-0.74775755,-0.99994093,-0.25891548,0.9474095,0.7987114,0.8310989,0.60125536,-0.19985884,-0.42119205,-0.88033795,0.7065677,0.2742917,0.41925833,0.99999976,0.22798581,-0.095905356,-0.5510245,-0.37864548,-0.6146227,0.17930432,-0.49677986,0.52692413,0.084893465,-0.050506227,-0.12642981,0.47981414,-0.23413895,-0.31062034,-0.3438506,-0.6775687,-0.44034967,-0.43239388,-0.3276199,-0.12176668,-0.265118,-0.038742453,0.21122308,-0.1634323,0.032102164,0.4824873,-0.08970921,-0.023450004,-0.46507084,0.23850149,-0.9955907,0.8497829,0.08139446,-0.5580722,-0.096238725,-0.24434498,-0.14445248,0.085124016,0.99927694,0.5971189,0.6180583,-0.32316276,0.5787397,0.6377077,-0.5736405,-0.53102773,-0.3637157,0.29487884,-0.2771961,0.22442743,-0.70616055,0.4904421,0.88329196,-0.70603883,-0.87595576,0.21582772,-0.9953832,0.77070177,-0.49602845,0.010277689,-0.2869562,0.85833544,-0.5179446,0.7211563,-0.6638477,0.2685739,-0.22590418,0.59527344,-0.5999422,-0.3196449,-0.81960654,-0.66129273,0.6016302,-0.58896345,0.11155976,0.648104,0.04850785,-0.29079282,0.4189482,-0.9528801,0.42009813,0.99817604,0.29750904,-0.39080966,-0.20547447,0.4920691,0.009777159,0.6122145,-0.65312934,-0.026498685,0.60339826,-0.62421674,-0.4858226,0.057287183,-0.5176479,0.7102354,0.25036246,-0.99988085,0.23022214,-0.94271666,0.5717787,0.9990822,0.18090199,0.16796677,-0.24510646,0.60242766,-0.9707825,-0.8296726,0.1659596,-0.6582417,0.4876728,0.23953374,-0.38488835,-0.24297646,0.5830492,0.6263038,-0.2410207,0.52058756,0.15537089,-0.98928744,0.99999976,0.9878982,-0.14169621,0.30392537,-0.7405561,-0.54411656,-0.35315433,0.8496621,-0.12395443,-0.14567691,-0.73532754,-0.57177407,0.03283836,0.52459687,-0.5475893,0.6635688,-0.43749613,-0.24049298,0.9973987,-0.9020973,-0.77430815,-0.5067206,-0.29030573,0.87374085,-0.66265506,0.8442534,0.8716236,0.15738076,-0.041231833,-0.23601238,-0.6343806,-0.8530384,0.9458797,-0.26187956,-0.037282176,0.05501473,0.71723187,0.2148387,-0.66381156,0.10794254,-0.17627597,0.38801393,0.7707229,-0.9173136,0.2604017,-0.42493525,-0.049126107,0.6256566,-0.08512782,0.514853,-0.08460396,-0.52530915,-0.25033814,-0.4242393,0.9998892,0.27475047,-0.08390592,0.42053854,0.077041335,0.83158714,0.99998474,0.23001496,0.49794403,0.19198267,0.10839561,0.11131286,-0.12125863,-0.99949133,0.041748244,-0.33122256,-0.8465603,0.17247133,-0.8794492],
    [88,1,"COP(=O)(OC)OC(Br)C(Cl)(Cl)Br",0.7953673,-0.2656842,-0.8432206,0.20794384,-0.19627135,-0.33975068,-0.96529526,-0.091238365,0.18560949,-0.64164716,0.17720412,-0.009126737,-0.37618223,0.6618403,0.15853311,-0.6665701,-0.527748,-0.029160801,-0.7094621,0.34911644,0.824949,-0.015840372,0.6882258,-0.049944215,-0.68040985,0.41277722,0.123838514,0.6367398,0.6769923,-0.48417518,0.7038102,0.020143226,-0.3382436,0.14812313,0.8127246,-0.29284853,0.27323002,0.6897107,0.9136575,-0.83826625,-0.93747616,0.27652434,-0.64866966,0.3221489,-0.5742943,-0.97607297,-0.21160068,0.642204,0.9974756,-0.032691624,0.042542778,0.27177647,-0.62365144,-0.17956787,-0.9308777,0.40489835,-0.6319836,0.73215413,-0.441658,0.41655034,-0.38052857,0.35814908,0.19587857,0.31469685,-0.6703832,0.41334268,-0.3895986,-0.40934804,-0.19018236,-0.01254529,0.12263745,-0.94032604,-0.26049367,0.8136235,0.1368717,-0.8180114,-0.25845817,0.19004905,-0.40340507,-0.9997913,0.43653697,-0.13690577,-0.6203488,0.01194582,0.6201815,0.089219004,-0.04638105,0.027286379,-0.3599658,-0.3595622,0.41230965,0.6651557,0.13018811,-0.18672559,0.9891316,0.04942638,-0.068718724,0.42491198,-0.78010076,-0.5113894,0.52238303,-0.28320232,0.09066575,-0.58181375,0.057755962,-0.8632398,0.46723098,0.6485373,0.9871126,0.18982974,-0.05642115,-0.5780302,-0.5387828,-0.736747,-0.36326578,-0.29817095,0.010537092,0.56776994,0.9993427,-0.22213334,-0.089579485,0.39922422,0.4602841,-0.37114257,-0.5551608,0.45317253,-0.022449141,0.4118445,-0.01746212,0.9988348,0.38649276,-0.70536983,-0.007110594,-0.49658522,0.42121747,-0.96490204,-0.36270317,0.17398307,-0.10222232,0.041517697,0.9932403,-0.78796506,0.9587372,0.19084722,-0.19233212,-0.6684158,-0.44809994,0.5902847,0.8975311,0.30313146,0.5870711,-0.81834924,0.17276324,-0.27155447,-0.67949826,0.29212308,-0.33217418,0.9958119,-0.91796464,-0.9427845,-0.9659302,-0.70007676,0.5578751,0.5573442,-0.02187349,-0.64978564,-0.18168063,0.23081325,-0.6880138,0.22744642,0.04253988,0.5781244,0.24133156,0.46207613,0.5965546,-0.7840301,-0.8188068,0.73957384,-0.32056898,-0.4187675,0.53169715,-0.95657533,-0.5111183,-0.6166779,-0.14287278,0.5052929,0.7813791,0.5874271,0.017023586,0.006101567,0.082892,0.07383282,0.07099382,-0.76441735,-0.11953881,0.032042887,0.6847077,-0.6139271,-0.20026492,0.58258176,-0.2836909,-0.2629537,-0.58715457,-0.57582337,-0.18716592,-0.3810143,0.2578384,-0.2713658,0.37198064,-0.99817073,-0.28061154,0.6958997,-0.3141875,0.29594854,0.46067584,0.12839526,-0.65027463,-0.25625247,-0.18050757,0.10906089,-0.02950304,-0.257545,0.62899035,-0.37730658,-0.9535572,-0.120381996,0.64440775,0.007637946,0.3504103,0.3052355,-0.4519605,-0.20851384,-0.22383821,-0.4965192,0.17824778,0.20181571,0.015014702,0.63098204,-0.2714335,-0.3136975,0.9481756,0.16352944,0.19459668,0.112138115,-0.67814755,0.29158783,0.632598,-0.39442122,0.3782068,-0.4541305,0.14235958,-0.9998995,-0.5598886,0.28625622,-0.74035877,-0.31291896,0.36128405,-0.731529,-0.3705412,0.20686725,-0.3003362,0.51873505,0.6641936,0.31466946,-0.14346807,-0.5267154,-0.343727,0.8661762,0.91188484,-0.014664574,0.034225073,0.99815035,0.68442684,0.511122,0.44612342,-0.43224514,-0.05510935,0.5507818,0.54500437,-0.260179,0.46677506,0.99835604,-0.8989874,0.12605055,-0.78264177,-0.48974118,-0.78897357,0.8351563,0.78849065,-0.9093601,-0.32462817,0.9993344,0.5905357,0.6911589,0.41847724,-0.57449925,-0.99255735,-0.9354082,0.40314487,0.3249053,-0.4854579,0.09663845,-0.1170083,0.45269945,-0.6246301,0.08621721,0.97184604,0.5146469,-0.15392561,0.28290468,0.35545614,0.07480501,-0.47030476,-0.47609192,-0.12370315,0.042410504,-0.06468027,0.20450407,-0.9999455,0.7281981,0.40168303,-0.34766293,0.066773154,-0.7599808,0.64064234,-0.6912502,-0.037171345,-0.7376178,0.007800844,0.4005175,-0.56896526,-0.16829117,0.06678438,0.58741343,-0.5159911,0.19040728,0.16780043,-0.33617905,-0.4414626,0.15143825,-0.20039059,-0.34235248,-0.5527209,0.21496788,0.6250959,-0.1544247,-0.08820862,0.61284554,0.142957,0.8043188,-0.97952944,-0.41111982,-0.23474075,0.70028627,-0.10143322,-0.48174667,-0.6597396,0.9998144,0.5082399,0.77408373,0.060795978,-0.28401095,0.2835172,0.3402953,-0.47567236,-0.49144423,0.6411058,0.72149223,-0.09623617,-0.34594232,0.4121624,0.3678959,0.32836404,0.55723625,-0.12208284,1,-0.35106993,0.09066939,0.31506032,-0.22610922,-0.82322025,0.3346833,0.2596317,0.23966992,-0.36025244,-0.5971416,0.09781366,0.2836786,-0.73310494,0.06857662,-0.43490177,-0.10729865,0.27153364,0.3608762,0.781851,-0.95852345,0.50088876,-0.1858227,0.48711368,-0.13323677,-0.3127153,-0.3361711,-0.123743996,0.40128392,-0.31643432,0.369005,-0.06936271,0.004819883,-0.32191095,0.3862581,-0.5649455,-0.3159628,0.7664775,-0.36047858,0.5445764,0.71750516,0.9999997,-0.68107,-0.8667291,0.005746584,0.9983665,0.0994562,-0.6539495,-0.99989283,-0.30890438,-0.08236574,0.1738792,-0.80325323,-0.588405,-0.8409986,0.13887995,0.48755163,-0.39982563,0.3415914,-0.33310404,-0.18831383,0.09066703,0.26218405,-0.9999806,-1,-0.99510574,-0.2976393,-0.58754086,-0.4616478,-0.1997576,-0.24260145,-0.42351705,0.17360517,0.62154293,0.7915539,-0.5352077,0.027961334,0.53484464,0.4511164,0.6445511,-0.18246168,0.013313645,-0.96048266,-0.99982566,0.0998557,0.10507765,0.19420357,-0.5010208,-0.08780558,-0.78629774,0.35133478,0.542103,0.5989737,0.39935184,-0.76427054,0.33382362,-0.90619093,-0.13330987,0.12808613,-0.21767497,-0.02202425,-0.3660421,0.31735715,-0.5207815,-0.061386097,-0.68639606,0.023908863,-0.997297,-0.5096127,-0.20939843,-0.27629057,0.57305586,-0.41590637,-0.72532547,0.75953496,-0.60587543,0.6099042,0.3292888,-0.30550924,0.2640074,0.14895861,-0.54048806,0.07147827,-0.18842165,0.99987966,0.6916443,0.34367672,-0.08402284,0.5435776,-0.4302024,0.15178996,-0.8330216,0.18175596,0.36845934,0.070279956,-0.08020307,-0.1964382],
    [89,1,"CCc1nn(C)c(C(=O)NCc2ccc(C(C)(C)C)cc2)c1Cl",-0.8483229,-0.59695476,0.49052894,-0.32729703,0.11637031,-0.6658423,0.53903025,0.28469697,0.16207688,-0.5914806,-0.5284094,0.5793517,-0.24179314,0.68829983,0.28002137,-0.5259733,-0.56839556,-0.856646,-0.13717502,-0.3387963,0.47208613,0.16577223,0.533589,-0.31402713,0.32342067,0.27657148,0.611129,0.16576546,0.20425937,0.24898951,-0.23861961,0.026283637,0.32646847,-0.3224819,0.782588,0.23513244,-0.66921353,-0.14452277,0.9976641,-0.27377087,-0.9977677,-0.17236781,0.62991273,0.15914634,0.21014597,-0.63630515,0.09885555,-0.18089814,0.4632981,0.4496736,0.10511813,-0.069077134,-0.17174713,0.22248334,-0.15117507,-0.12644656,-0.10553827,-0.5245689,0.016146958,-0.21086332,0.5150768,-0.13891004,0.18541029,0.42415428,0.34173432,-0.11863884,0.13607953,0.17365347,-0.53498864,0.016761163,-0.9596927,-0.9319572,0.22336383,-0.49841994,0.9056746,-0.18980046,-0.2787602,0.18328755,0.19590302,-0.9992737,0.15033042,0.054712612,-0.96410435,0.2499662,0.41518888,-0.9445037,0.06825971,-0.47434607,0.31420225,0.01630958,-0.46165967,-0.2864725,-0.7324432,0.47168803,0.9790835,-0.1938739,0.6567347,0.14767623,-0.25850064,-0.19210991,-0.02336948,0.56551135,-0.26456067,0.96916854,-0.9766818,-0.8036643,-0.57677466,-0.41541728,-0.89700156,-0.42345402,0.16048774,0.29425898,-0.21078816,-0.42976055,-0.2177984,0.3422418,0.45585567,0.04029334,0.98778313,0.40986702,0.16276374,0.83384377,0.2623993,0.2788386,0.0553377,0.4472995,0.688947,-0.3751206,-0.71494734,0.9998979,-0.49143687,0.38492617,0.25397602,0.11265951,0.1938989,-0.9967811,-0.32775337,0.1658319,-0.5728976,0.62533444,-0.9999776,0.79835105,0.8834878,-0.5035096,-0.108894475,0.12220512,-0.035286203,-0.7074218,-0.5521036,-0.048572235,-0.6610583,0.5994891,0.009993927,0.10709394,-0.21849252,0.40427876,-0.3254397,0.47495908,-0.6558499,0.5711978,-0.8008146,-0.19743025,0.16633007,-0.26913214,0.4202007,-0.062323574,0.23158328,-0.21100631,0.73767805,-0.07873662,0.02849485,-0.28301817,0.53398067,0.28872463,-0.015225384,-0.42918316,-0.2556347,0.5283955,-0.118430406,-0.107881375,0.24945892,-0.30847082,-0.4712311,-0.13877226,-0.5993046,-0.6288837,0.22010481,0.26882106,0.78188777,-0.64036864,-0.8451749,-0.2552454,-0.52664787,0.058897,-0.35674295,0.46380404,-0.14400397,-0.9065011,0.28957137,0.29145247,-0.3944246,-0.57200223,0.23659639,0.3206725,0.2717593,-0.42722163,-0.49109495,-0.65950793,-0.5529298,-0.99981886,-0.5472573,-0.6433383,-0.15682413,0.13771935,-0.15076298,0.63853896,0.052282214,-0.74643546,-0.072765164,-0.5031852,-0.4015657,-0.76516616,0.27916566,-0.5413148,-0.9676551,0.24488474,0.15083745,-0.124359034,0.23819679,0.22109781,0.43047345,-0.052796472,0.7737764,0.5139735,-0.22047472,-0.32266906,0.119433306,0.5196201,-0.6623516,0.43756342,0.8892587,0.37336874,0.22357497,-0.57132965,0.19645543,-0.017861089,-0.6474977,-0.67397624,-0.01830769,-0.06588392,0.26182833,-0.97796214,-0.25863343,0.48790136,-0.09396569,0.18734506,-0.27795383,0.6353544,-0.5466015,-0.563277,0.33144465,0.678543,0.26397654,-0.63084096,0.74045485,0.312304,0.17856866,0.64420676,0.78890735,0.17220381,-0.32323256,0.87593055,-0.31133652,-0.77793974,-0.22234163,-0.70799327,-0.22536106,0.22064494,0.16168249,-0.73375404,0.6367778,0.9989635,0.09535563,-0.10822358,0.28809065,-0.34936595,-0.44557154,0.4117096,-0.6281388,0.03952037,0.16601428,0.9501574,0.8285317,0.09229866,0.21285251,-0.121013336,0.9999819,-0.9888327,0.10580053,-0.40334567,-0.123998016,0.35843766,-0.720201,-0.19207153,0.70645785,0.12362053,-0.90997446,0.34774673,0.9231631,0.10039499,0.4559068,-0.69919133,0.1278349,0.085948266,0.72858137,-0.60004866,-0.11469779,-0.05620425,-0.98493636,-0.43270522,0.0364699,-0.07521588,0.5373075,-0.482292,-0.3090192,-0.52375716,0.36163393,-0.96100485,-0.1306749,0.17643833,-0.5915039,-0.29787955,-0.18212324,0.44461855,-0.2320226,0.51915216,0.29343864,0.17064285,-0.53557193,0.49142385,-0.17662042,0.043122593,0.39601263,0.023929605,-0.2709473,0.079673946,0.34655142,-0.07744579,0.19084144,-0.7992354,-0.9780637,0.2769586,0.38347673,-0.029009296,0.5057892,-0.39724222,0.5475815,0.99987215,0.028088389,-0.7616802,-0.50863516,0.3664081,-0.42557955,0.04947838,-0.7292886,-0.62409437,-0.33519304,0.047058523,-0.37793133,-0.2473319,0.16593559,0.74982965,-0.27796537,-0.3465348,-0.019984197,0.9951392,-0.2362861,-0.41427124,0.39491168,-0.36917335,-0.23723294,-0.3073046,-0.27846944,0.30446696,-0.55805624,-0.3176591,0.3563859,0.79372185,0.41884708,0.51574135,0.3983862,-0.47780213,-0.12298088,-0.20537193,0.6421408,-0.26000154,0.15308554,-0.5677866,-0.6676803,-0.27916926,0.07230588,0.6713817,0.75117964,0.11385469,0.2302111,-0.38694203,-0.30039415,-0.61161375,-0.47479123,-0.6700853,0.26178905,-0.42222145,-0.19378555,-0.037548874,-0.5757901,0.36554536,0.99997836,0.13075474,-0.98125744,0.24617879,0.9998718,0.2285662,-0.2782858,-0.99946547,-0.4907342,-0.5707518,0.007908313,-0.2697138,0.19472171,0.28787777,0.18751125,-0.42311984,-0.14707132,-0.28086844,-0.267811,-0.041332584,-0.16499099,0.8071781,-0.99998665,0.99672574,-0.09369003,0.42501345,-0.66858345,-0.5923602,0.56775314,-0.7868921,-0.77524203,0.34364125,-0.6081574,0.32038176,-0.48533276,-0.2058106,-0.634096,0.088987075,0.4444869,0.37226254,0.38968542,0.3920384,-0.9999323,-0.112122886,0.07822138,-0.11708056,0.56071246,-0.32890943,-0.96170306,0.15761209,0.09707846,0.09408461,-0.6075777,0.1420148,-0.2056698,0.97938514,0.38138688,0.8055808,0.29571325,-0.13413595,0.019283347,-0.4513517,-0.20861222,0.365127,-0.65597785,-0.36560103,0.97284526,0.4616633,-0.7905223,0.17800105,-0.00702846,0.12728387,0.26348662,0.6177032,0.669033,0.5237593,-0.03862829,0.991419,0.75991255,0.004911074,0.027685152,-0.1528363,0.7736718,0.9999691,0.07720024,-0.15524095,0.42924592,-0.17379755,-0.032420173,0.07568772,-0.9906093,-0.76114875,0.55665916,0.69871956,0.64799476,-0.23187713],
    [90,1,"CC12CCC3C(CCC4=CC(=O)CCC43C)C1CCC2=O",0.48440495,-0.27379322,-0.18154258,-0.24384761,-0.29841617,-0.1323862,0.5503241,0.14069062,0.45115805,0.46128827,-0.53134966,-0.20248747,0.3624193,-0.073221005,0.12282295,0.6191719,-0.33424583,-0.4223576,-0.03611425,-0.036471803,0.27525476,-0.096181065,-0.4508018,0.018833358,-0.03828523,-0.29220298,-0.12146601,-0.08074379,-0.078536436,-0.56271106,-0.6045891,0.14936315,0.7843855,0.4266577,-0.008860032,-0.4846873,-0.2574001,0.021847205,0.9972423,-0.1588907,-0.9072503,-0.18036109,0.42087442,-0.019254824,0.3483157,-0.668447,0.3347802,-0.003160153,0.99465775,-0.3693969,-0.07684778,0.4771586,-0.21572866,0.52747184,-0.8939868,-0.2737953,0.22239736,0.25859386,0.47969824,-0.39341512,-0.05569442,-0.23713171,0.5067597,0.5032847,0.4465516,0.43820882,-0.26153773,-0.38039088,0.26354483,0.75568163,0.59363216,-0.7677782,-0.118848324,0.8696251,-0.32569683,0.83487797,-0.5150064,0.12387042,0.59865755,-0.99996924,-0.3000736,0.38821653,-0.3281881,-0.26066363,0.60464174,-0.8662806,0.39672777,-0.29753396,0.3102514,0.0281692,-0.44355592,0.37129238,0.5405774,-0.19188385,0.9924188,-0.4543053,0.75071645,0.44809034,0.15053284,-0.4345996,0.23401795,0.4633147,-0.1837753,0.8858462,-0.9887056,0.53328747,-0.37036455,0.20216796,0.97482157,0.07748294,-0.6124202,0.018512005,0.02763812,-0.63499653,0.26497784,0.123010635,-0.28129444,0.47385016,0.988616,0.737623,-0.020892208,-0.087661795,0.24190143,-0.17634405,0.31498775,-0.1458741,-0.03922703,-0.23653917,0.21606787,0.9998393,-0.007905311,0.083504476,0.44033426,-0.07857031,-0.28313807,-0.98990303,0.6030047,-0.2851921,0.07801622,-0.62841403,-0.99960685,-0.09827045,0.78352594,-0.27741626,-0.2604501,-0.11969122,-0.25757572,0.34284502,-0.88487464,0.5908906,0.1948617,-0.93556505,0.86101216,0.32531947,0.42488608,-0.4965843,-0.7000677,0.19407855,-0.5040856,-0.90351945,-0.8688695,0.11509995,0.6658768,-0.13784194,0.5016412,0.263599,0.1313022,-0.5746009,0.025360757,0.33947498,-0.20491758,-0.20785159,-0.39156428,-0.85916644,-0.45308995,-0.98299223,0.8877877,0.39203858,0.5059021,0.16436303,-0.23259048,-0.8844011,0.76946956,0.30196372,0.009611384,0.35383263,-0.32670853,-0.5249919,0.60341746,0.19755158,-0.8970028,-0.21616113,-0.5569696,-0.4755384,0.19470464,0.18954073,-0.5557834,-0.8710904,0.287225,-0.48121408,-0.04800062,-0.29250932,0.09895335,-0.70753914,-0.5160776,0.71825284,-0.26728007,-0.6371154,0.6565497,-0.9999137,-0.35034913,-0.4202187,0.21536763,-0.6657581,-0.12305763,-0.39559716,0.2130044,0.47426003,-0.19220269,-0.8033659,-0.6822906,0.38975596,-0.7499862,-0.7430171,-0.8151259,0.4204898,-0.18695898,0.31494498,-0.23636322,0.1732735,0.29470226,-0.81400096,0.16333862,0.08020402,-0.22527684,0.19274218,-0.7463602,-0.27455065,-0.090425454,0.030236548,0.81395394,0.13081726,0.8454927,-0.6083329,-0.90254015,0.2934015,-0.5458973,-0.080722995,-0.28973126,-0.68503916,-0.23719342,-0.5334383,0.32640028,0.17361706,-0.062565565,-0.19329293,0.51539576,0.30697307,-0.20794535,-0.121951826,-0.62883365,0.40044537,0.20463182,-0.57878935,0.62406427,0.28952888,-0.12662831,-0.84480244,0.8624678,0.19784361,-0.15507942,0.9919796,0.001355353,-0.36672392,-0.54005075,0.59060866,0.013261948,-0.8532919,0.32935864,-0.5215282,0.018128555,0.9969793,-0.24593136,0.39275572,0.28962466,0.3007671,0.21444629,0.90452206,0.601645,0.05322034,-0.38254547,0.9379901,0.24008536,0.07410676,0.6195387,0.6770584,0.99998283,-0.9944201,0.93714976,0.09369093,0.40540922,-0.19283698,-0.02966116,-0.5956373,-0.8368122,-0.9889011,-0.8485389,-0.44438756,-0.40255696,0.2918541,0.74739665,-0.14999944,0.32698092,-0.4077146,-9.34e-05,0.6254488,0.34575942,0.28728884,-0.99986607,-0.16059326,0.31212044,-0.3037523,0.28836083,-0.4709716,-0.20861882,-0.004846142,0.20405668,-0.8084516,-0.32548645,0.49393407,0.06871951,-0.274495,0.69289404,-0.08513163,-0.049889114,0.69428,-0.005103487,0.13220671,0.48190695,0.34988734,0.18158871,-0.09316688,0.8706376,-0.44208047,-0.30415303,0.8724118,-0.112812445,-0.5651428,0.012414455,-0.6915595,-0.9482604,0.17517306,0.055488203,-0.29449096,0.55906713,0.20596,-0.10617879,0.9988294,-0.632459,0.0641026,0.16665049,-0.26318118,-0.23891598,0.7607911,-0.88549435,0.66322535,0.30935207,0.648957,-0.1461751,-0.19490103,-0.6304707,-0.5051133,0.71692485,0.42377296,-0.08962795,-0.99988383,0.18318194,0.61147887,-0.1501436,-0.5334483,-0.6749385,-0.47327998,-0.019538883,-0.505141,-0.4616161,-0.02589203,0.07563248,-0.54635495,-0.18486749,-0.8221425,0.18941893,-0.12797916,-0.5864721,-0.34728017,-0.21821424,0.36728787,0.40877244,-0.031450495,0.5867462,0.47850296,0.41208106,-0.057014257,-0.68683916,-0.35929203,0.33323526,-0.73022103,-0.6682629,-0.3629153,0.099084206,-0.17204767,0.30125347,-0.5962902,0.03778855,0.01197639,-0.2866081,0.09141695,0.9999995,0.6743106,-0.8989706,0.23204185,0.99724567,0.17570148,0.09708603,-0.9999465,0.760997,-0.43885383,-0.30555886,0.06249527,0.6074118,0.33478308,-0.43258917,-0.6774748,-0.60647416,0.0631489,0.4635654,0.5046189,0.26661393,-0.1758051,-0.9999312,0.9999999,-0.49476126,-0.2549027,-0.5022709,0.9467962,-0.35479242,0.3273118,0.8431372,0.3512139,-0.24138048,-0.15368451,-0.0038312,0.14251605,0.16127747,-0.30252108,-0.024181873,-0.070667304,-0.015961153,0.33013922,-0.9997087,-0.6776052,-0.1671577,0.5816731,0.22158642,0.15041623,-0.91587675,-0.21215531,-0.27829972,0.36329955,0.12983006,0.8197454,0.06871998,0.100828014,0.4055895,0.7511482,0.25790557,-0.060723927,-0.06423441,0.44001296,0.2611304,0.29448295,-0.4124961,-0.49139667,-0.9553586,-0.011273564,-0.2063505,0.71236974,-0.8708924,-0.24401653,0.3927792,-0.9714719,0.10210512,-0.5172123,-0.3083477,0.99158853,0.38228768,0.23987181,-0.77755696,0.16699168,0.28686613,0.99995625,-0.20584464,-0.72329223,-0.008805803,-0.45503923,-0.56845677,-0.338232,-0.9977568,0.46727452,-0.15726638,0.42021245,0.78510755,-0.27159604],
    [91,1,"Cc1c2ccccc2c(C)c2c1ccc1ccccc12",-0.6822091,0.09536269,0.63602465,-0.1384623,0.59859616,-0.43176794,-0.6796362,-0.14498726,0.3552165,0.20560254,-0.8946453,-0.10220554,0.13120669,-0.4696579,-0.5897386,0.55132765,-0.64637077,-0.10236353,0.24445835,-0.3386608,0.3846026,-0.7774315,-0.18616797,0.38672724,0.5609054,0.61353177,0.7579426,0.010247505,0.7035455,-0.062459394,0.035806064,0.27850327,-0.43236324,0.05479492,-0.03983701,-0.3137643,0.3643204,0.18930088,0.9971721,-0.945375,-0.92519593,-0.83784646,-0.38631994,-0.23408008,0.15002602,-0.89804995,0.22697501,0.14121716,0.98379517,-0.016107405,-0.35652873,0.27114058,0.15742657,0.26558316,-0.9809239,0.17155838,-0.7686663,0.35446575,0.011168409,0.43712506,0.018743092,0.4305213,0.38641056,-0.014257817,0.28533772,-0.013029417,-0.394575,0.55698544,0.21959005,0.62175983,0.97416025,0.58815396,-0.12720092,-0.8388069,0.9415378,-0.41516808,-0.6061619,-0.5379995,-0.2769539,-0.99891496,-0.31418025,0.030419433,-0.77657866,-0.09301696,0.22549076,-0.9692656,-0.24392442,-0.40741387,0.038214494,0.13579492,0.46181476,-0.2761291,0.1407852,0.27327514,-0.39739817,-0.013909827,0.9226785,0.32173672,0.66332275,0.08373048,0.66377026,0.021257292,0.25527948,0.29952666,-0.94983983,0.5361396,-0.38927412,-0.23175693,0.98556566,-0.32563692,-0.4464242,0.738711,0.14020553,0.1227197,0.026529586,0.4716769,-0.47846958,0.56616783,0.9946579,-0.22851822,0.41983426,-0.5459582,0.010884711,-0.09987772,0.056463826,0.06920342,-0.12110077,0.39980704,0.028802067,0.99997693,-0.6251682,0.47541255,0.20701613,-0.4071734,0.42130363,-0.9566116,0.82080245,0.7958465,-0.8007188,-0.5554647,-0.99998695,0.3976975,0.9933687,0.70507985,-0.48020053,0.660173,0.4103638,0.6736974,-0.3250144,0.048686385,-0.3366934,-0.80244535,0.14153647,0.030740928,0.23473382,-0.37924945,-0.2693205,0.7568968,-0.67876035,-0.9068504,-0.9203436,-0.2542121,-0.40653574,0.22107363,0.5409508,-0.06235788,-0.10366597,-0.3289007,0.1479691,0.7900755,-0.7773814,-0.5509733,0.035973348,0.04430174,-0.5993753,-0.93086314,-0.8428634,0.49806154,0.16144593,-0.48400652,0.2578395,0.84021765,0.6261521,0.23588492,-0.2718044,-0.5851182,0.12685063,-0.031215666,-0.6131667,-0.19687735,0.5319054,0.015072518,-0.2977737,0.5520418,0.26322368,-0.3137433,0.41088971,-0.6859536,0.70136917,-0.12846547,0.6217524,0.71518797,0.016922921,-0.2649391,0.6791283,0.33375612,-0.09462244,-0.5211627,-0.06834558,-0.99988973,0.08642042,0.65434587,-0.063311875,0.42257732,0.22074267,-0.63607216,0.3355737,-0.19196443,-0.3867898,0.3753103,0.5202633,-0.46880352,-0.7910531,0.32413474,-0.9742309,-0.5721588,0.6921674,-0.07294918,0.4069904,0.3807457,0.2645007,-0.63519573,-0.09396872,-0.39637467,0.41416958,-0.3957685,-0.43059763,0.4080282,-0.7033204,-0.14244886,0.783613,-0.076093614,0.7093199,-0.5692961,0.71925133,-0.04380132,-0.07876866,0.14941205,0.111984566,-0.36612746,-0.107899375,0.111794755,-0.5350282,0.3135029,-0.06601921,0.03991423,-0.108301975,0.54959875,0.13457699,0.43277532,-0.5879153,-0.046385463,-0.5628975,-0.3618022,-0.3441404,0.053391553,-0.39821768,-0.25310713,0.81997144,0.6152025,0.504511,0.93973106,0.3488788,0.14275856,0.83138776,-0.13076943,0.02759193,-0.1425969,-0.038226005,0.1322745,-0.2421619,0.9989942,-0.11523681,0.6537722,0.50777656,0.40954795,-0.6325166,0.95622396,0.94600004,0.3290238,-0.6183514,0.9806523,0.26268244,0.36205277,-0.52625346,-0.4092042,0.9999995,-0.99941456,0.661852,-0.47216055,-0.37984577,-0.35046571,-0.30247015,-0.28215742,0.3686952,-0.99501204,-0.47706518,0.23338538,-0.4189182,0.10825309,-0.5161707,-0.7343906,0.7423478,0.1597231,0.9456943,-0.28911337,0.0464671,-0.26402262,-0.99986064,0.07714219,-0.16126454,0.77146643,0.5488972,0.006343341,-0.85982525,0.41450343,0.7882118,-0.9676082,-0.32247576,0.60178155,0.48169082,0.5088825,0.61624765,-0.33776802,-0.6899772,0.98416495,0.11526564,-0.026281886,-0.6434576,0.07655582,0.21273251,0.43946844,0.72399706,0.08105755,-0.50283766,-0.19771266,0.1918119,0.16261747,-0.32639235,-0.34026355,-0.9855023,0.75229186,-0.40083033,0.7426207,0.50559396,0.281868,-0.09480076,0.9995503,-0.02183242,-0.52153856,0.054077614,-0.18399893,-0.52751243,-0.24652797,-0.96999604,0.24444307,-0.53210676,0.23552589,0.21809398,-0.046219353,-0.056331437,-0.16949295,0.7466302,0.74383086,-0.062468797,-0.9999989,0.45203248,0.24850611,-0.17683212,0.18215063,-0.9121969,-0.5179163,-0.28495005,-0.41448107,-0.40483552,-0.52342916,-0.25974712,-0.0833495,0.42767844,0.8355805,0.44213048,-0.30050153,-0.6470934,-0.46227643,-0.15921733,-0.03900684,0.33853865,-0.73228943,0.8725326,-0.4608841,-0.96897286,0.65828025,-0.23568633,0.6819548,-0.35290265,-0.64093524,-0.08997224,-0.81761277,-0.08474069,0.59824985,0.55404824,-0.2855307,0.24942331,0.012536247,-0.5259859,0.06316141,0.99999946,0.74673736,-0.9257886,-0.091632865,0.9992889,0.08818673,-0.3507253,-0.99995446,-0.30700824,0.39728355,0.78991604,0.13973212,-0.5143058,0.18861113,-0.6215397,-0.91592264,-0.8097853,0.091069646,0.053531874,0.195684,0.041821193,-0.30850834,-0.9999733,1,-0.8662903,0.2957681,0.41304633,0.29627976,-0.3150579,-0.63241005,-0.52150136,0.5380906,0.26516303,-0.45175382,-0.8913784,-0.7250797,-0.50608677,0.010159598,-0.15340516,0.2698417,-0.06670177,-0.017865276,-0.9998946,-0.5510895,-0.5792352,-0.56696016,0.06929515,0.11926028,-0.9990758,-0.44522443,-0.45228973,0.34325725,-0.2704261,0.40029296,-0.5286559,0.99259317,0.52443886,0.00423247,0.39023876,0.42594007,0.06544275,-0.71807605,0.2732,0.4958231,-0.058909185,-0.8799032,-0.9763967,0.41418472,-0.2548847,-0.38588223,0.15639454,0.31255645,-0.46887225,0.73988295,0.55115163,0.185865,-0.1170115,0.98122954,-0.19354865,-0.16467762,-0.20525551,0.052509453,-0.19192569,0.99885124,0.7194535,-0.32325366,0.25398952,0.4656239,0.20957945,-0.28117368,-0.9747169,-0.45607856,0.57890487,0.58347213,0.74559796,0.32233962],
    [92,1,"O=C(O)C1(c2ccc3c(c2)OCC(Cc2ccc(-c4ccccc4)cc2)C3O)CCCC1",-0.63353026,0.21348776,-0.48939407,0.073268265,0.25328174,-0.6605145,0.06673103,-0.109769076,0.13800736,0.30239803,-0.30450717,-0.20256297,-0.59584814,-0.73863083,0.15542388,0.5911744,-0.23834388,-0.15359318,-0.025286367,-0.39985713,0.22227375,-0.2957487,0.12916528,-0.55816406,0.020548545,0.025863256,-0.4356934,0.55389076,0.68605703,-0.18306229,-0.05588362,-0.12339816,0.5013219,0.07676041,0.45700097,0.008138346,-0.78542,0.47899792,0.99953437,-0.562057,0.55704874,-0.27574092,-0.25119045,-0.30736828,0.51243424,0.8854265,-0.08508526,-0.1519974,0.18027161,0.5096671,0.45264196,0.6172695,0.100824766,0.53553814,-0.5355118,-0.50541484,0.06963781,-0.90747464,0.2683182,0.36381084,-0.33427718,-0.5131016,0.568117,-0.120357096,-0.14445098,0.03793848,0.1184279,0.2780233,-0.089645356,0.691185,-0.8566103,0.31905398,0.34197098,0.086895905,0.62918216,0.1715193,0.6294211,-0.16629837,0.094864964,-0.99608827,-0.72042626,-0.5251699,-0.85547566,0.038494844,0.25755104,-0.9904792,-0.4650522,0.15753344,-0.09655356,0.008961184,0.4137166,0.32140893,-0.22347118,0.43726796,0.9864375,0.27035016,0.8181336,-0.27526155,-0.642607,-0.08425885,0.047028422,0.0994306,-0.35138714,0.99118084,-0.99971145,0.20882587,0.22227325,0.28851742,-0.99909246,-0.48922396,0.13478294,0.003511022,0.29849592,-0.1034023,-0.052092277,0.53695905,0.61386275,0.79283273,0.2732613,0.4575642,0.059681576,0.30209216,0.49267197,0.325053,-0.44900542,0.7511903,-0.14288674,-0.17996071,0.567953,0.99997914,0.14294659,0.5702685,0.4850348,-0.18269722,0.24735433,-0.6631822,-0.12658852,0.59933656,0.028836157,-0.23929292,-0.9999999,0.11998133,0.46923038,0.07379827,0.81170136,-0.03711924,-0.42680693,-0.2209851,-0.99895966,0.17330927,0.5503988,-0.84098965,0.83055055,0.22178672,-0.3822266,-0.46423262,-0.7774804,-0.98908263,-0.5713607,-0.110072315,0.538104,0.28044674,-0.3023299,-0.5375246,0.5168911,0.028935656,-0.45646006,0.6192757,-0.44016454,0.032824293,-0.44145063,-0.23041452,0.2143715,0.84812367,0.07756728,-0.95460826,0.8135502,0.23046228,-0.097265676,-0.07965361,-0.13642484,-0.53910583,0.009293231,-0.062371448,0.8888739,-0.22530147,-0.07363107,-0.10696728,0.21797663,0.7856187,-0.58977807,-0.33219665,0.29223454,0.068131074,-0.1336108,0.408565,0.3655336,-0.021083854,0.31866616,-0.013998179,-0.13745971,-0.54378265,-0.44584826,0.36280543,0.6034442,0.71073717,0.19489518,-0.41961977,-0.39611912,-0.99984956,-0.25922856,-0.6255508,0.5024755,-0.7153743,0.7104797,-0.40734074,-0.18849836,0.09009664,0.62018615,-0.549986,-0.046532854,-0.25340044,-0.5117522,-0.3137812,0.99999654,-0.24799664,-0.18223666,0.10529817,0.49132836,0.10090917,-0.10748956,0.41771457,0.5238831,-0.3520633,0.1597581,-0.1548469,0.1405214,0.42250088,-0.31602192,-0.16512631,0.8569855,0.22619411,0.070090674,-0.75677043,0.2380693,0.16057287,0.35275525,-0.5137666,-0.044771124,0.41481256,0.5257733,0.6924434,-0.25251937,0.45024642,0.19308227,0.58057576,-0.15590714,0.25005162,0.19264068,-0.17217705,0.2765046,0.3966187,0.029826334,-0.5125739,0.52408534,-0.34150904,-0.27902988,0.7358382,0.19081701,-0.1869847,-0.6545809,0.9957821,0.23902453,0.08857448,-0.3717586,0.82481813,0.1826805,-0.7836639,0.259979,-0.50772136,0.7113073,0.9063481,0.26990122,0.3114541,0.07036967,-0.51280725,-0.57917666,0.72233754,-0.7386585,0.099104315,0.32028297,-0.8408187,0.4174631,-0.54840857,-0.49320906,0.6140547,0.9999998,-0.9971134,-0.54711634,0.17832898,0.24575715,-0.78549767,-0.11268889,-0.46682423,-0.59293216,-0.8996184,-0.99957156,-0.27183583,0.9478167,-0.058935218,-0.38991004,-0.17693338,0.16024849,0.37515482,0.60515183,0.06681837,0.13004702,0.26975518,0.9462598,-0.5581173,-0.105539516,0.5319774,-0.046088047,-0.6768874,-0.86134887,0.21029517,-0.12347585,-0.89754134,-0.003320812,-0.279613,0.3283613,-0.36719555,0.38115042,-0.5017048,0.08154673,0.88454956,0.032878365,0.2744693,0.6602403,0.4675293,0.2768036,0.105644524,-0.05883499,-0.002615915,-0.26227525,0.636897,-0.47632828,0.1296134,-0.16718355,-0.9870587,-0.27547684,0.30753383,0.13293226,-0.33377528,0.049221106,0.47832474,-0.67144513,0.99849945,0.12343053,0.29092592,-0.103058174,-0.533511,-0.008366049,-0.40107054,-0.9651198,-0.199572,-0.8555509,-0.08181275,0.39406088,-0.003605001,-0.15365699,0.3574027,0.33053124,-0.62903255,0.7389001,-1,0.33808896,-0.12128342,0.4143024,-0.26135957,0.002063286,-0.17566614,0.2697934,-0.36165807,-0.49830857,0.087948106,0.43253362,-0.10255674,-0.10100951,-0.48976764,0.024137316,0.13369773,0.2810127,0.36111957,0.56179726,0.87538815,-0.25476965,-0.6043945,-0.3253302,-0.8436355,0.66410166,0.3573436,-0.5792699,0.112227246,0.40187114,-0.69790304,-0.71902645,-0.7691538,-0.76880914,0.6273988,-0.010210941,-0.21052942,0.6298093,-0.40601403,-0.36291832,-0.17578237,0.77760625,0.41969046,-0.99003786,-0.34846273,0.99734914,-0.44582158,0.48413375,-0.988085,-0.38468024,-0.70166266,-0.33902183,0.109866284,-0.29113024,0.7248516,-0.53900653,-0.9392442,-0.38377377,0.4124958,-0.3284202,-0.060089678,0.38100854,-0.69944364,-0.9995989,1,0.9319882,0.1530787,-0.3032757,0.042169984,-0.3687804,-0.61684275,0.35954237,0.065828525,-0.42772356,-0.36964342,-0.8491933,-0.45834157,-0.13446559,0.6742227,0.35068268,-0.40471599,-0.14535649,0.99315006,-0.9953254,-0.25853464,-0.30431297,-0.3941278,0.09930794,-0.8272045,-0.93287045,-0.034367934,-0.6044963,-0.3892318,-0.38674006,-0.32663465,0.3550188,0.97792304,-0.74599713,0.398986,0.559468,0.5061726,-0.027555695,-0.8540905,-0.0971741,-0.17856818,-0.06892052,-0.7970546,-0.9673102,0.7172336,-0.29676726,0.16406694,0.59156746,-0.7084491,0.7785592,-0.3893304,0.096503116,0.52899724,0.15690121,0.99970025,0.38422877,0.031537946,0.14877415,0.060744237,0.574755,0.9998116,0.53212863,-0.26641068,0.5526651,-0.01142008,-0.17905536,-0.076959215,-0.997955,-0.8025804,0.5741049,0.30809835,0.83835053,0.6320189],
    [93,1,"Oc1cc2ccccc2c2ccccc12",-0.5811052,0.24336663,0.5087332,0.47841674,0.21193372,-0.063058116,-0.42704573,-0.038308017,0.4023904,-0.21708952,-0.84853226,0.06394503,0.20928097,-0.5174148,-0.44722712,0.8165773,-0.37202182,0.060818385,0.30152425,0.053163525,0.50971043,-0.868329,-0.028064352,0.43213323,0.42558107,0.35772315,0.5968869,0.34837326,0.46266404,-0.15434831,0.24489816,0.16643652,-0.02578716,0.13416314,-0.32778046,-0.3365571,0.4301163,0.30022526,0.9104207,-0.9588868,-0.9858236,-0.30307037,-0.14959458,-0.37664476,0.3532526,-0.9911098,0.11175745,0.23785068,0.9792709,-0.018497288,-0.23706451,0.028556434,0.16351905,-0.047654692,-0.9776136,0.11279613,-0.7466898,0.88041276,-0.039224684,0.41844326,-0.19379464,0.27244014,0.72277147,-0.29960603,0.41765088,0.24235465,-0.29145908,0.60711485,-0.07786855,0.38414612,0.932909,-0.7701995,0.47941026,-0.7390069,0.7607573,-0.08698947,-0.16936986,-0.001970002,0.07596942,-0.9955666,-0.62914336,0.25775516,-0.7741761,0.27493474,0.13765977,-0.7133334,0.11101117,-0.3866196,-0.11881873,0.20498165,0.17433305,-0.43264806,0.04873093,-0.19843225,-0.0779747,0.10196761,0.641556,0.077208295,0.12914789,0.2243526,0.6619779,-0.21106426,0.16967142,-0.46589223,0.32111633,0.08819391,0.032180946,-0.021410076,-0.71579623,-0.09038362,-0.59892654,-0.07480749,0.070019916,-0.21134798,-0.26328215,0.6388913,0.07776154,0.2271504,0.99864733,-0.33511814,0.093184076,-0.75804836,-0.14026469,0.048552405,-0.30167225,0.10095659,-0.32235107,0.51760274,-0.4657707,0.99982494,-0.2495262,0.058156535,0.33739316,-0.5452284,0.2378952,-0.5354029,0.87766784,0.6975336,-0.6095849,-0.13032706,-0.9999351,0.31851125,0.9955158,0.600023,0.6133769,0.10865194,0.079149336,0.11825491,0.9122826,-0.1964687,-0.23708469,-0.4710143,-0.07866356,0.45012522,0.011481755,-0.37978062,-0.23551294,0.99121094,-0.50559574,-0.45306113,-0.984383,-0.15090431,-0.48618168,-0.15116112,0.14048569,0.29691014,-0.46619546,0.065373965,0.004738196,0.63594115,-0.87494314,-0.4206516,0.47188297,-0.16422473,-0.3077623,-0.95568025,-0.83598167,0.5369789,-0.40636966,-0.16636112,0.556612,0.54424405,0.37548098,0.31362194,-0.83637697,-0.5010711,0.070374966,0.05112273,-0.49501973,-0.061044317,0.80595106,0.16134597,-0.041322235,0.4459206,0.12806834,-0.30921847,0.20085734,-0.43172964,0.751667,0.12620994,0.33805206,0.7768583,-0.5219111,0.23428257,0.6751354,0.11356363,0.35767102,-0.2101736,0.24169816,-0.99630636,0.038006525,0.03251397,0.08521979,0.29928625,-0.09786599,-0.5306771,-0.3777915,-0.003628478,-0.43871057,0.38362578,-0.26559362,0.077837005,-0.6567782,0.33147162,0.959294,-0.32192937,0.11309546,0.20094374,-0.1842172,0.21050298,-0.17303206,-0.48474702,0.67443323,-0.5292307,-0.10503911,-0.35824084,-0.5577652,0.2821547,-0.54494077,-0.066872306,0.8661192,-0.30648518,0.37320268,-0.27369368,0.7744585,-0.14191818,0.14628378,0.23349826,0.07263534,-0.14774358,-0.23591946,-0.7026252,-0.4645491,0.36470208,-0.05622021,-0.18893613,0.3021847,0.21445341,0.4648361,0.3194732,-0.5002095,0.44565436,-0.34114596,-0.5241914,0.04465111,0.23358227,0.019430269,-0.21664087,0.16501494,0.5399485,0.3770406,-0.28730187,0.18174635,-0.21020518,0.42026564,0.8839917,0.26552552,0.51487756,0.005155268,0.44816026,-0.008553397,0.99942446,-0.41583037,0.7098009,-0.11471402,0.25306422,-0.3774747,0.09226043,0.555653,0.030728301,-0.03490093,0.99812794,0.41383374,0.6589735,-0.63069814,0.176826,0.99999386,-0.99460423,0.2279453,-0.101147845,-0.17691152,0.10443295,-0.5301903,0.24169223,0.112098336,-0.956594,0.9585503,0.4143363,-0.6898378,-0.14727634,-0.26924738,-0.5883135,0.55328,0.1868777,0.9221051,-0.2839121,0.3380602,-0.35569844,-0.9777629,0.037972398,0.15990622,0.67182195,0.4704658,-0.45208806,-0.7205114,-0.3044285,0.67051333,-0.9736915,-0.2160573,0.46743807,0.5789074,-0.18505609,0.50125647,-0.74639946,-0.13592502,0.81682205,-0.048597544,-0.14658701,-0.52057153,0.2859206,0.30922347,0.04860073,0.33712912,0.5488291,0.2588144,0.37260106,0.18048552,0.08268558,-0.32200822,0.7144161,-0.9956854,0.5437652,-0.26462054,0.39846414,0.651916,0.5922517,-0.2535436,0.9988329,0.2337104,0.10019655,0.2803855,-0.20719501,0.1780809,-0.25062734,-0.93864745,0.04577298,-0.2586739,-0.46025833,0.17847803,0.09056808,0.08955169,-0.4092708,0.7646631,0.9397817,-0.49153844,-0.96664536,-0.030724354,0.2889518,-0.19780153,0.4305161,-0.9174531,-0.13439775,-0.36830378,-0.44325817,-0.4957367,-0.55347234,0.057649855,0.106480345,0.31512263,0.9128329,0.21230221,0.26387703,-0.5994585,0.07634509,-0.35561067,0.116076134,0.40606013,0.09329254,0.8781157,-0.04662184,-0.96091413,0.06302737,0.13591368,0.36285445,-0.6749426,-0.68101066,-0.3725194,-0.5724704,-0.14479463,0.4360269,0.40367857,0.2382958,0.4618654,-0.05525681,0.15450588,0.0642297,0.99995184,0.2651906,-0.97025144,-0.1529202,0.99943376,-0.5607602,-0.36159095,-0.99851733,0.014833068,0.675912,0.7666837,0.14883769,-0.56780267,0.43529877,-0.2900162,-0.5046194,-0.6178435,-0.2434896,-0.48346654,-0.28847444,0.21046993,-0.43311155,-0.9999591,0.9999994,-0.9882165,-0.005660033,0.30164474,0.21105652,0.13713445,-0.68192923,-0.822709,0.6480068,-0.5061664,-0.46816716,-0.9221173,-0.7041733,-0.12611511,0.020575987,0.02595455,0.45164984,-0.15464391,-0.93462837,-0.9999174,-0.6647424,0.036033273,-0.08105665,-0.041144565,-0.19186693,-0.9964629,-0.35287067,-0.7971952,-0.14188199,-0.033915084,-0.005882451,-0.15978883,0.9849372,0.3828967,0.38560247,0.39492047,0.65023065,0.09441985,-0.74754167,-0.26167443,0.5324137,-0.11765566,-0.56034744,-0.62747115,0.23443174,-0.17085832,0.002446797,0.26917216,-0.1902042,0.013488767,0.7552776,-0.02875568,0.3025869,-0.062126767,0.19628456,0.31816787,0.001690025,-0.17457679,0.5212255,-0.031021561,0.9980961,0.7249242,-0.28276688,0.062069226,0.024699403,-0.20959303,0.07537086,-0.39631313,0.06415071,0.38416013,0.1389753,0.58497286,0.20264356],
    [94,1,"CCn1nc(Cc2ccccc2)cc1C1CCN(CC2CC(N(C)C(C(=O)O)C(C)C)CC2c2cccc(F)c2)CC1",-0.87128115,-0.04430007,-0.36334395,-0.26506567,-0.6118138,0.03052705,0.50177467,-0.21590583,0.11174068,0.121237375,-0.692945,0.007413132,-0.27723464,-0.33504254,-0.09500038,-0.321051,-0.86325705,0.24149191,-0.1258086,0.4309066,-0.60520554,0.78466046,0.2098749,-0.096453324,-0.069450095,0.014231065,0.79362804,0.46708998,0.21038917,0.63370544,-0.06543142,-0.5508229,0.47888666,-0.65063167,-0.5530821,0.5238273,-0.46688414,-0.15632316,0.9997315,-0.05298084,0.9027557,0.2234373,-0.33675507,-0.40354866,-0.6358055,0.9984995,0.19822799,0.52029234,0.04040218,-0.10894858,-0.41285884,0.3468407,-0.5411602,0.6195192,-0.026750885,0.31986716,-0.20671445,-0.99580115,-0.68855226,-0.48858246,0.27117622,-0.42561486,0.675387,-0.44217122,0.584909,0.19187957,-0.76159173,0.354484,-0.7311488,0.56388766,-0.99019337,0.93306214,0.38003644,0.28962106,0.78342766,-0.10302592,0.058660753,-0.30026403,0.20371512,-0.9915302,0.1427074,0.39738977,-0.9892716,-0.516942,0.34191784,-0.99616426,-0.21243432,0.13553417,-0.41864046,0.16911542,0.6054514,0.02625771,-0.6534845,-0.40627202,0.9816277,-0.47759685,0.7955148,-0.38467455,-0.68902755,-0.13089164,0.07200805,0.75569963,-0.09037728,0.98475623,-0.99997437,0.3170503,-0.66431344,0.6957731,-0.95837325,-0.85705674,-0.53451735,-0.7000145,0.71809,-0.65209407,0.5037116,0.3289618,0.06589978,-0.25231856,-0.9930652,0.7129133,0.31444418,0.52518123,0.36738366,0.24809875,-0.14225015,0.43726897,-0.60602254,0.30891913,-0.2600646,0.99998325,-0.38849646,0.19469902,-0.15414035,-0.24769175,0.031028746,-0.98371345,-0.24730971,0.18645304,-0.053199258,-0.55782837,-1,0.5570687,-0.4418095,0.06358979,-0.30964208,0.053448,-0.13198043,-0.34284917,-0.99999124,0.41333193,-0.012919465,-0.568108,0.623844,0.5381706,0.45716932,-0.12450592,-0.3200924,-0.99995565,-0.6626824,-0.7826857,0.993061,-0.31430104,-0.37723613,-0.56833535,0.0582111,-0.51793885,0.41032547,-0.5412199,-0.46909842,-0.18214701,-0.0850695,-0.24431814,0.79248303,-0.0909717,-0.11576759,-0.8248451,0.5894023,0.5606544,-0.58587635,-0.8084953,0.16950376,-0.47565544,-0.5974876,-0.07059339,0.9866404,-0.26311353,0.4630315,-0.5496324,-0.17601185,-0.043848816,-0.80808294,0.48492134,0.7188794,0.26672128,-0.108492136,0.72078323,0.52582216,-0.8509015,0.36462677,0.6091944,0.30492032,-0.74528944,0.052639883,0.27040604,0.6752327,0.1886458,0.05160945,-0.690592,-0.56956834,-0.99984175,0.51857734,-0.04074308,0.52006567,0.35024595,0.39399946,0.18758208,-0.2574956,-0.26824552,0.11654503,-0.5748433,-0.1044794,0.28552592,-0.4949356,-0.47985217,0.9831926,-0.036708552,0.38846922,-0.6613881,-0.15043277,-0.53936106,0.079203695,0.5664631,0.67501915,0.49584788,-0.2214642,-0.7060473,-0.49209884,0.33260894,-0.085004635,0.2599057,0.9336198,0.2676679,-0.60790366,0.7379332,-0.5424294,-0.3697051,0.09485797,-0.23989834,-0.24910949,-0.012483293,-0.42595747,0.34555793,-0.60592234,0.12752876,0.07868987,0.68406886,-0.23918888,0.41914463,0.23175883,-0.30348346,0.24560659,0.3344865,-0.18894285,-0.4743783,0.4286024,-0.6496189,0.016704235,-0.32633072,0.88473237,0.4465718,-0.27669156,0.999936,-0.21857572,0.2532059,0.87776613,-0.6586195,0.19677855,-0.8421452,-0.78422207,-0.10650922,-0.092334084,-0.95377547,0.43466344,-0.2171185,-0.26224953,0.6344963,0.61020815,0.9780773,0.027977692,0.050467372,-0.1581624,-0.99970245,0.13461752,-0.11229264,-0.08909349,-0.16267186,1,-0.99688894,-0.6917849,0.14741871,0.17621022,-0.8594702,-0.06697935,-0.30898225,0.4824868,-0.43282187,-0.99998856,-0.36352196,0.9543551,0.01510183,0.020249084,-0.38325837,0.48595154,0.06675221,0.6914817,-0.40460396,-0.29413638,0.7345014,-0.85517406,0.49528483,0.47723973,0.4812917,-0.39540043,-0.39089212,-0.5732447,-0.42314577,0.625163,-0.8977242,-0.5020452,-0.3919177,-0.15965568,-0.79406726,-0.30072445,-0.60811895,-0.024750551,0.9827163,-0.754446,-0.3971416,-0.48185155,-0.19026513,-0.32560074,-0.06541848,0.5793977,-0.64875,0.45347604,-0.54292333,-0.07962239,0.77426755,0.15428232,-0.9988393,0.9869876,0.29034448,0.02856979,0.3063327,-0.26878545,0.0638616,-0.5590442,0.999387,-0.13025197,-0.8546804,0.38594818,-0.75776905,-0.000711206,0.38458514,-0.9542761,-0.5510746,0.5066631,-0.13740863,-0.71701896,-0.25604513,-0.071937785,0.09217516,-0.628636,-0.95651233,-0.051658183,-1,0.31892323,-0.8718542,0.503873,-0.06225694,0.96697783,0.47928247,0.7558929,0.3427539,-0.051033624,0.437088,-0.002662421,0.11625125,0.21090764,-0.94966376,-0.13673647,-0.6669727,-0.8466342,0.21045615,0.001308236,0.6758905,-0.26587608,-0.9508859,-0.5582043,-0.7708314,0.92799586,0.658081,0.15724698,0.14641394,-0.0786858,-0.21474244,-0.288067,-0.74032253,-0.55529827,0.633541,0.27845174,-0.7319273,0.39032203,-0.2454432,0.19634603,0.82780874,0.99930286,0.62140423,-0.98063135,0.58141315,0.9959926,0.003659478,-0.20927733,-0.9993856,0.7666137,-0.9619723,-0.72889626,-0.28844094,0.23562363,-0.053998817,0.26274487,-0.9599043,0.031579696,-0.09070846,0.59097517,-0.017877573,0.46495622,-0.18704577,-0.46489364,1,0.9991388,-0.35639343,0.10167194,-0.8891172,-0.20141537,-0.7567678,0.8593811,0.6478487,0.6571515,-0.7086569,0.39718372,-0.19232278,0.6371937,-0.18604268,-0.32973275,-0.43458092,0.47799203,0.9998623,0.61434954,0.30033675,0.061922994,-0.42590955,0.22213879,0.3108123,-0.857875,-0.2877537,-0.31765458,-0.9633023,-0.018034158,-0.1695259,-0.83704674,0.9597124,-0.033231124,0.66173035,-0.003862773,0.5606336,-0.41288278,-0.19902106,0.6407719,0.7457036,0.42467564,-0.5926478,-0.9630435,0.29720932,0.20865828,-0.50349444,0.7022378,-0.36887965,-0.18062405,-0.56499696,-0.3869689,-0.21947818,0.25184846,0.9999137,0.31612334,-0.764323,0.43523815,0.13635434,0.62417996,0.9981264,0.8192923,-0.516456,0.63339424,-0.51173997,-0.615521,0.67152536,-0.998887,0.4815029,0.74631923,0.5769284,0.6447054,0.016255023],
    [95,1,"Cn1c(=O)cc(Oc2ccc(F)cc2F)c2c[nH]c(=NCC(C)(C)O)nc21",0.2435715,-0.3111979,-0.005172076,0.35850206,0.40864098,0.1230967,0.08360974,-0.81385064,0.08345519,-0.596596,0.21980779,-0.35751402,0.3904284,0.1636498,-0.41570988,-0.3799683,0.7212296,-0.21902248,0.47067386,0.65222704,0.4527243,-0.25953865,-0.4564856,0.7776687,-0.53477687,0.31352597,0.019572686,0.00746573,0.16801633,0.2716136,0.38160402,-0.0939432,0.09999812,-0.08562929,-0.52723414,0.6244234,0.4710236,0.4235746,0.99938995,0.1466717,0.41595322,0.13385971,0.5212975,-0.11768854,0.439607,0.53578305,0.30796796,0.7536252,-0.2989621,0.49732122,0.35738295,-0.50800693,-0.62003016,-0.8430638,0.6438805,0.36927786,-0.4686338,-0.82930523,-0.4051625,-0.5351008,-0.23067959,0.4756244,0.53505194,0.24597739,-0.45093563,-0.095169604,0.51914614,0.09280035,-0.073339336,0.70253986,-0.9898935,-0.98798573,0.4053089,-0.8079107,-0.09864514,0.22596684,-0.3206111,0.31526485,0.32563016,-0.9993866,-0.6132598,0.094776645,-0.9536984,-0.5456752,-0.6351104,-0.5217831,0.18657896,0.3898413,0.18376915,0.2835805,-0.30858985,-0.047573414,0.44125834,0.031902492,0.9996934,0.52709144,-0.33973894,0.5062192,-0.45617133,-0.030387735,-0.042430025,0.4350064,-0.25316188,0.8087028,-0.9990076,-0.91535485,0.28719926,0.22320127,-0.99995863,0.25147513,0.11367494,-0.35406327,-0.15832217,-0.12275154,-0.38931262,0.3533529,-0.32749015,-0.18570802,0.94876313,-0.53159416,0.26340503,-0.56279063,0.5668984,-0.5635207,0.088085294,0.15257356,-0.2875323,-0.32240048,-0.36004314,0.9958131,0.39970085,-0.34855267,0.14368747,0.14089346,-0.18271965,-0.9485154,-0.23190312,0.27263752,-0.5688939,-0.6462874,-0.99999726,-0.046099104,0.14389776,0.46260104,-0.6050489,-0.45889193,0.32918945,0.15714504,-0.99280643,0.85342354,0.36068556,-0.6662148,-0.30442965,0.13532475,0.8743744,-0.5240199,-0.30900458,-0.8532906,-0.46425557,0.1053265,-0.3245948,-0.5933743,-0.21220891,-0.06785506,0.33017373,-0.69327784,0.32313713,0.07189599,-0.24414,0.42819774,-0.42386374,-0.18106191,0.30473733,0.25110495,-0.069898315,0.40664026,-0.4930237,0.15124954,-0.179426,-0.012107305,0.6413217,-0.94421834,-0.15271172,-0.75241685,0.8310452,-0.2316523,0.3051532,0.26641324,0.4308044,-0.61661994,0.28455526,-0.10501038,-0.48914832,0.7473437,0.4123287,-0.37722754,0.64202493,-0.6757269,0.5652156,-0.2805344,-0.10794087,-0.65115654,-0.33180195,-0.20746815,0.03287255,0.29394117,0.011386197,-0.12531191,-0.020326752,-0.9999206,0.5046234,0.07696921,-0.73817664,0.62576115,0.58142346,0.63552654,0.17551073,0.41104478,-0.21442178,0.49739385,-0.037471127,0.6316119,0.2907264,0.501379,0.9952945,-0.430504,-0.004756245,0.4844887,-0.8507566,0.21185596,-0.20912637,-0.7585239,0.021105308,-0.37618998,-0.032062057,-0.63131267,0.31608862,-0.3987318,0.35837907,-0.056617245,-0.9606776,-0.2510638,-0.18928345,-0.41241255,-0.19446681,-0.5184431,-0.20405509,0.753411,-0.32571378,0.5370101,0.38008797,-0.7026912,0.56220156,0.32562977,0.57393456,-0.6637231,-0.21254322,0.6297324,-0.223542,-0.04131119,0.19616199,0.048155896,-0.07852861,-0.13848862,-0.46495664,-0.51419204,-0.59018373,0.039304454,0.43357772,-0.13802527,-0.38835183,0.9997493,0.59301424,-0.010195818,0.414818,-0.44749513,0.80152225,-0.076157086,-0.18202044,-0.5614039,0.13154921,0.9823782,0.29189304,0.24932487,0.024672305,-0.022834335,-0.41907343,-0.5148067,-0.96636236,0.08260507,-0.16817987,0.39052972,0.6163568,0.6337552,-0.22770368,-0.3232228,0.99999875,-0.84184116,0.8310462,-0.30733633,0.4002193,-0.52261627,-0.570592,0.5848309,0.47732884,0.28646415,-0.99562967,0.53515047,-0.01110856,0.30644014,0.40673622,0.013309342,-0.2213294,-0.8039721,0.017319923,-0.077458136,-0.24079365,0.5166984,0.9638852,0.6656858,0.112867095,-0.65272117,0.39189577,-0.09753283,-0.048398465,0.8220235,-0.4308075,-0.29706776,-0.77253336,-0.26146898,0.12651365,0.042164683,0.26982817,0.3995233,0.46939662,-0.5198524,-0.3726877,0.049148317,-0.14689383,0.07921805,0.37386572,-0.037579186,0.000335749,-0.59827435,-0.09244325,0.10386307,0.4029283,-0.6333012,0.23470983,-0.91624236,-0.5863204,0.16311088,0.3396102,-0.6949439,-0.5940122,0.49901497,-0.015325063,0.99971515,-0.5306469,-0.25702953,0.71698207,0.23598029,-0.69324386,-0.30537727,-0.41078004,-0.66143554,0.17443389,0.5934447,0.88777065,0.6311225,0.5764578,0.50217944,0.3046333,-0.9436417,-0.6981568,-0.9970493,-0.19664204,0.25260755,0.04562084,0.85796785,-0.29282987,-0.75852305,-0.19099411,-0.15512356,-0.49657595,-0.13490151,-0.57895696,-0.23828402,-0.22682406,0.7607826,-0.03270675,0.52038014,-0.13267525,-0.2884026,-0.38831228,-0.43847853,0.0803746,0.71652263,0.41785616,0.2730255,0.95379466,-0.40992257,-0.6683895,0.3430139,-0.4163988,0.47274378,0.31822324,-0.708406,0.1533959,-0.017878348,-0.31333154,0.318614,0.08888791,0.40330124,0.89732933,0.15920228,0.8639979,0.7732917,-0.9867514,0.02291322,0.99976045,-0.18839844,-0.29763818,-0.9636747,-0.1347705,-0.5203648,0.06375598,0.33811837,-0.15690339,-0.341102,-0.42296895,0.04280987,0.5769388,-0.27598846,-0.65266025,-0.45967105,0.33201972,-0.23553254,-0.9999379,1,0.4090471,-0.44447124,0.17095107,-0.56815463,0.17104577,-0.6327845,-0.22245124,0.5272731,0.04931105,0.87995696,-0.61898607,-0.26616868,-0.005612882,0.6311471,0.61412257,0.6126462,0.53000593,0.9183402,-0.9994058,0.32189777,-0.4277599,0.15102735,-0.56173277,0.25535536,0.2611145,0.5865673,-0.42862725,0.21359049,-0.742091,-0.09084452,-0.7448089,0.9719028,-0.17659615,0.82117647,-0.27798638,0.18928713,0.14951786,-0.55931133,0.44983795,0.15292099,0.49689177,0.31731996,-0.90724576,-0.085112974,0.53658724,-0.06267589,0.52175945,0.48086572,0.16461135,0.64582705,0.49229792,0.51912045,0.23433803,0.9991325,-0.051042203,0.1693033,-0.34357053,0.76217884,-0.12933503,0.9999361,0.7377123,0.003306503,-0.7937811,-0.005028545,-0.43186128,-0.6072696,-0.99914986,0.3902538,0.30083445,0.29310858,0.24487846,0.026707184],
    [96,1,"COc1cc(S(=O)(=O)O)c(C)cc1N=Nc1c(O)ccc2cc(S(=O)(=O)O)ccc12",0.448251,0.1366973,-0.6305947,-0.07929733,-0.03019734,-0.1453704,-0.51065236,0.44177482,-0.24716191,-0.2256646,-0.11745064,-0.04412612,-0.1175491,0.29033113,-0.525,0.72274405,-0.22038285,-0.58162725,-0.7587034,-0.7604595,0.7667083,0.60722625,0.5648832,0.8891918,-0.39968294,0.122991726,0.5942323,-0.12042108,-0.11495508,0.3628595,0.4283837,0.19918399,-0.860147,-0.5378515,-0.38665715,-0.6006009,0.49878436,0.22609149,0.99989396,0.18319137,0.7680404,-0.5629255,-0.11321436,0.14765227,0.60790557,0.93990046,0.64556533,0.6000465,0.855473,0.27976337,-0.29803854,0.1701543,-0.33416063,-0.14547466,-0.009918386,0.51096106,-0.85352725,-0.9686056,0.26775795,0.007471603,0.21860543,0.6554673,0.17016838,-0.6832043,-0.78577864,0.5288321,-0.44240138,0.076378495,0.58255064,0.7773519,-0.84026045,-0.8795549,0.19156191,-0.7733887,-0.6547815,0.44257054,0.21966454,-0.9237362,-0.52773297,-0.9994939,-0.94366807,0.19275704,-0.88255143,0.21132556,0.2396633,-0.62155926,0.26107523,0.3795814,0.033608247,0.20080529,0.26738063,0.28523678,0.0243491,0.5248989,0.99994063,-0.500466,-0.8336869,-0.3141567,0.018786862,0.0266278,0.44284287,-0.62750745,0.07391185,0.7719693,-0.9998494,-0.917419,-0.4013393,0.86660177,-0.9999247,0.50058615,-0.7637942,-0.45796818,-0.7301529,-0.42237267,0.090771094,-0.2203705,0.7247119,0.5399696,0.65831494,-0.7514986,-0.34012958,-0.39231,-0.818518,0.008523318,-0.9201265,-0.22724526,0.2423489,0.3101172,0.08154697,0.99775946,0.1013582,-0.3236123,0.033328857,-0.58283496,-0.31960997,0.34566528,0.19058238,0.08444959,-0.7430147,-0.2739583,-0.99999654,-0.12537198,-0.8912521,0.55399626,-0.42905194,-0.6491905,-0.34599,0.3657686,-0.9997355,-0.113642044,0.22310932,-0.77980745,-0.36140993,-0.3894551,-0.08222891,0.6166516,0.15990697,-0.9949527,-0.86043,-0.7326993,0.3449551,-0.04987574,-0.41885257,-0.06756292,-0.43572015,0.38256374,-0.37563226,0.3592524,0.16647243,-0.20460002,0.4712798,-0.7005856,0.27571428,-0.4021284,0.562686,-0.21879295,-0.7020962,0.07626188,-0.6660407,-0.515778,0.6243768,-0.9999534,-0.51545703,0.2754369,0.99017084,0.48221332,0.072370775,0.052949242,-0.31045264,-0.49307063,0.74089545,-0.054376967,0.017476637,-0.81362087,-0.18956831,-0.5659819,0.6352598,0.9284987,-0.7774387,0.26423785,-0.42645958,-0.07776777,-0.36412254,-0.6331359,0.11265515,0.71830964,-0.60061234,-0.4074608,0.15967317,-0.999919,-0.08517297,0.026096536,-0.46742457,0.5013089,0.8391989,-0.19517446,-0.024966441,0.52519685,-0.5069296,0.13897677,0.4258548,-0.24998857,-0.63353133,0.6713975,0.99999833,0.05684208,-0.35049438,0.3270873,0.19118458,0.1840639,0.5897339,-0.5266422,0.10060836,-0.414179,-0.6246499,0.08417996,-0.24005431,-0.16396989,0.1372148,-0.41295442,0.92363954,0.6845323,0.6569298,-0.5780483,0.62891847,0.63101834,0.668531,-0.30371824,-0.7767273,0.2510696,-0.16583996,-0.7170664,-0.5510823,0.7820128,-0.7582611,-0.15581718,-0.28829524,0.435874,-0.35818142,0.6142928,-0.43782723,0.3539784,0.45836836,0.23221557,0.5915144,0.81155086,0.3591288,0.12684795,0.18513957,-0.08527818,0.15239614,0.99926895,0.44598532,-0.19926473,0.8799671,-0.5322514,-0.6316365,0.52423185,-0.1604803,0.4636916,0.62619525,0.7353738,-0.8380332,-0.20974004,0.08115093,0.20789415,0.03483236,-0.38561383,-0.9913019,0.54175025,-0.09984567,-0.80797803,-0.45030487,0.5869578,-0.15515496,0.1746284,0.99999905,-0.592853,0.23752393,-0.52910656,0.17539136,0.5605141,-0.9067287,-0.2961494,0.11129228,-0.7394556,-0.99930334,-0.21203046,0.38665757,-0.5713425,0.621899,-0.102893844,0.7181655,-0.6845615,-0.9944728,0.34575838,0.20598432,0.009179045,0.9992544,0.3813333,0.055095095,0.54176724,-0.18345918,-0.9115285,-0.46518135,0.7132716,0.5102702,-0.6320563,0.28549263,0.44430813,0.71533364,0.03149438,-0.116689324,0.24183945,-0.4769545,-0.36013436,0.61638963,-0.554159,0.5030558,-0.40419844,0.19932589,-0.10342918,-0.15727845,-0.18582107,0.16108191,0.087156914,0.65580624,-0.7777656,0.6148378,-0.9906406,0.59886575,0.35514256,0.39391783,0.20083208,0.19171585,0.68101335,-0.12363834,0.9989952,-0.046989236,0.63965005,0.3768761,-0.37933806,-0.251767,-0.2821307,-0.7189398,-0.6130449,0.43511772,0.6111696,-0.038050573,-0.33538806,0.8346101,0.40992334,0.84200805,-0.69127715,0.5200107,-0.99073905,0.46533412,-0.04485141,0.105757914,-0.24081703,0.34849274,-0.3510132,0.1299478,-0.0917415,0.10992799,-0.36630717,0.3775244,-0.12581901,-0.13583584,0.8450427,0.6487011,-0.15819664,-0.46606925,0.4248731,0.052185252,-0.85135496,0.6363821,0.32020822,-0.2855417,0.93046474,0.9979543,0.5672236,0.5454126,-0.2126774,0.65949476,0.004792027,0.68293947,0.9167817,-0.24832526,0.05528803,-0.6728498,0.052660458,-0.4514852,-0.60080045,0.41514665,-0.13917923,-0.91660154,-0.63716483,-0.9484684,-0.08136969,0.99855983,-0.46384805,-0.57997274,-0.8936732,-0.21532471,-0.5987322,0.45683342,-0.5359087,-0.25720233,-0.8975731,0.4449259,-0.2530427,-0.7748261,-0.6041111,0.493594,0.11879812,-0.054990243,-0.29098237,-0.99962634,0.99999964,0.71009344,-0.16531937,0.22754587,0.5823563,-0.65000945,-0.28922966,-0.50792605,-0.37203586,-0.11867424,-0.04697228,-0.8697229,-0.27653694,-0.6720744,0.17034003,-0.48778808,-0.30213398,0.13842064,0.97969824,-0.99338937,-0.39899576,-0.046904337,0.14092088,-0.5609819,-0.22889553,0.97397375,0.9371019,0.23389459,0.5575521,0.27820042,-0.2525652,-0.82785183,0.9920563,0.026670389,-0.62573344,-0.30297336,-0.38756323,-0.28512192,-0.21931915,-0.6114791,-0.8234575,-0.02674541,0.8713052,-0.99972045,-0.48894727,-0.79785705,-0.46915764,0.28092632,0.097058564,-0.3718106,0.88616806,0.11303641,0.77220875,0.2560021,0.9997152,-0.21838744,0.33312783,-0.6349629,0.043100055,-0.18327802,0.99982953,0.27834687,0.40568215,-0.65917236,0.55493766,-0.074584305,-0.29356685,-0.99808407,-0.24043773,-0.6856382,-0.36583072,-0.18693307,-0.7277215],
    [97,1,"O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1",-0.06519445,0.18279172,-0.39374185,0.05356673,-0.15658091,-0.36195323,-0.64222246,-0.069639996,0.647121,0.16664284,0.49306357,0.42657757,-0.31753144,0.29017755,-0.075862095,0.08979188,0.011696373,0.45641932,-0.059422266,0.610362,0.74187833,-0.45218092,0.46516433,0.1843996,-0.5045042,0.5619797,0.51684695,0.5554405,-0.3288181,-0.7513501,0.04193526,0.003143531,-0.33807608,0.2590799,0.536099,0.010387936,0.46774286,0.65845674,0.76569355,-0.44107226,-0.9955902,-0.20719573,-0.08563329,-0.2972214,-0.4434277,-0.9943917,0.2038529,0.29078773,0.9832863,-0.042849082,0.626304,0.17930509,-0.35610205,0.13575345,-0.8239315,0.042833365,-0.81410354,0.8059552,-0.03109604,0.724559,-0.44514465,-0.26507476,-0.53619355,-0.4209522,-0.5010409,0.6508564,0.66272545,0.4384446,-0.000673938,0.28151998,0.21489526,-0.9989289,0.3585003,0.0325934,-0.4811989,0.5233716,0.2264447,-0.21587539,0.121771954,-0.9983036,0.3452204,-0.52666944,-0.820507,-0.74719626,-0.2712567,0.7219565,0.14509043,0.047188032,-0.8556702,-0.06268351,-0.19080004,0.31835425,-0.2593096,0.13132463,0.99782103,-0.13442537,-0.64562696,-0.45021176,0.21339868,-0.21846768,0.7427441,-0.5257988,0.0734045,-0.5626285,0.5013684,-0.8560787,-0.029785963,0.2744519,-0.7903323,0.4025296,-0.24248865,-0.5945977,-0.6520648,0.05560844,0.57393235,-0.12558405,0.58778507,-0.32227552,0.99987257,-0.68495077,0.35678765,0.1579274,-0.38169232,-0.17583983,-0.7311958,-0.36532718,-0.09637314,-0.35323763,0.18437275,0.9482423,0.4873882,0.2998501,-0.30716524,-0.18192768,-0.45337784,-0.5149488,0.5129504,-0.20012826,-0.6340059,-0.45251378,-0.99791396,-0.14346386,0.42853686,0.43416512,0.1169456,-0.0672411,0.09092857,-0.18482529,0.9762022,-0.2926954,0.28305113,-0.42167225,-0.7499565,-0.17390397,-0.10448827,-0.5271876,-0.12085421,0.9974302,-0.53676826,-0.7541019,-0.9949558,0.105528705,0.06263545,-0.665193,-0.033374712,0.73762244,-0.61381483,0.41561157,-0.519219,-0.04640419,-0.5892837,-0.27661315,0.11832768,-0.085474975,0.49719724,-0.90301955,-0.8542526,-0.007784792,-0.4703026,0.42145962,0.2728918,-0.9995538,-0.3323938,-0.07074314,-0.60823166,-0.08136058,0.21179451,0.37373626,-0.7831686,-0.42111224,0.80959576,0.58007294,0.44157967,-0.5324827,-0.2130779,-0.11692601,0.52783054,0.982717,-0.21828821,0.4608534,-0.6981991,0.30072984,0.027850334,0.19866636,-0.4916144,-0.80072474,0.70803213,0.59067917,0.21150863,-0.947367,0.39443883,-0.035193346,-0.48076454,0.06315579,-0.10976267,0.61805904,0.67627686,0.053877268,-0.3217695,-0.25635195,-0.2853284,0.092311285,0.55386096,0.4810561,0.9810842,0.44744137,-0.33595484,0.68900937,0.29516968,-0.19249295,-0.5494574,0.57086784,0.23442166,-0.23503122,-0.7408273,0.10868525,-0.47525656,-0.14445265,0.22944053,0.39718485,0.21743928,0.517914,0.5266293,-0.023580799,0.3194626,0.589288,-0.33406213,0.5740234,-0.49999362,-0.5408157,-0.13811737,-0.99863464,0.12945358,0.38098195,-0.015080167,-0.47131327,-0.09229154,0.010137675,0.2222786,0.32054624,-0.77216846,0.4549264,0.27492815,-0.08826592,0.44278258,0.108416095,0.5336452,0.7653063,0.32544586,0.038736794,0.15208896,-0.2952232,0.83785737,0.63225114,-0.21512452,0.9070947,-0.37496054,0.3166208,-0.3084656,-0.016212665,0.6666896,0.9997814,-0.25486237,0.4935972,-0.03735604,-0.097577505,-0.36696166,-0.662554,0.11003598,0.08090338,0.5614158,0.9995947,0.27638936,0.81311595,-0.010166583,0.59965014,0.9997188,-0.08627811,-0.39231226,0.21471758,0.28755382,0.7466307,-0.6863774,0.59173244,-0.0934279,-0.09269693,0.9855676,-0.22336058,-0.44456062,0.38739192,-0.27544817,0.25930634,-0.04657041,0.32767308,-0.97358537,0.20251493,0.44397706,0.32236752,-0.99102235,0.68575203,0.5411376,-0.27423492,0.6110155,-0.7750901,-0.22920555,-0.40750727,0.3308526,-0.71328455,-0.5655842,-0.29839596,0.27422938,-0.36748305,-0.35397255,-0.7257253,0.11972225,-0.9447589,-0.41802707,-0.34733006,-0.36708382,0.3522792,0.71410257,0.41663885,-0.7289012,0.2144596,0.31627977,-0.28606826,0.3401386,-0.7670303,-0.53481203,0.82829624,-0.9939436,-0.038425226,-0.73641205,-0.2979265,-0.12606119,-0.22535138,-0.002537062,0.99902755,-0.042018663,0.77625936,0.3750916,0.65076774,0.24762788,-0.22392295,0.0159993,-0.17104776,-0.4086965,-0.16140771,-0.06924456,0.37701398,-0.27754182,0.28278244,0.56718636,0.7959695,0.42925835,1,0.09736683,-0.59154147,-0.5113822,-0.09903035,-0.8417177,-0.1664567,-0.37546265,-0.77849305,0.45805234,-0.49362937,0.5386415,-0.64503074,-0.4433494,0.83269405,-0.43924236,-0.29098576,0.2437115,0.6321155,-0.5980904,-0.80254215,0.6160805,0.81213295,0.8311084,0.76275784,0.84240705,-0.024811497,-0.09709046,-0.0499289,-0.027505625,0.23243086,0.20434022,0.99933,-0.3844708,0.088893265,0.71461624,0.40265194,-0.5027223,0.37950423,0.43596622,-0.2653172,0.9999901,0.25985053,-0.9844962,-0.004975605,0.9993637,-0.49102432,-0.25480872,-0.99837416,-0.6670352,0.5029339,0.7617779,0.14263482,-0.85779285,-0.41244796,-0.24255005,0.8301045,-0.037300393,-0.66997856,-0.35184395,-0.050665762,-0.28987616,-0.10266402,-0.9999928,-0.9987956,-0.99516356,0.6697067,-0.12710111,0.39129314,-0.3258177,0.15621242,-0.83179945,-0.47249046,-0.3916785,0.17767935,-0.8549027,0.49795714,0.25234836,-0.1755147,0.43403992,-0.23654725,-0.07434399,-0.98158085,-0.99999195,-0.21641445,0.35415745,-0.4273036,-0.33533052,0.16664891,0.6627671,0.85942596,-0.45586982,-0.46638924,-0.23879635,0.075553454,-0.3680704,0.9417452,0.029940182,0.6319149,-0.19387788,0.3715961,-0.2730121,0.64354223,-0.43915933,-0.13881668,-0.37265968,0.9113633,-0.059055213,-0.5709728,-0.4986514,0.014464988,-0.14815676,-0.61795366,-0.33942613,0.55035037,-0.5989595,-0.23150074,0.18167247,-0.51001644,-0.08828083,0.5025063,-0.8532132,0.46336758,-0.44411087,0.99954563,0.3962562,-0.33220473,-0.6955668,0.14716442,-0.51448417,-0.445441,-0.14984149,-0.40556052,-0.77213085,-0.63031363,0.67280245,-0.2378046],
    [98,1,"CC1(C(=O)Nc2ccc(O)c(Cl)c2Cl)CCCCC1",-0.7197776,0.53560776,-0.24976191,0.093933396,0.090737894,-0.6445678,-0.5568912,-0.40373263,-0.40895256,0.08279611,-0.59035844,0.34557518,0.008612694,0.42630127,0.13212994,-0.43939236,-0.22092438,-0.6609713,0.0917039,0.42083424,0.3812239,0.09424673,0.49616218,0.19086334,-0.52252644,0.1275015,0.52539146,-0.3221817,0.64020246,-0.7182675,-0.44266558,0.7344971,-0.004277826,0.014786947,0.12616195,-0.17503834,0.015471308,0.2569827,0.9873144,-0.8431147,-0.99167055,-0.2663662,-0.576119,-0.14406897,0.68333954,-0.9294374,-0.22965293,0.47329652,0.19417766,0.08534715,0.5101833,0.22053118,-0.31256244,0.1311737,-0.5238749,0.33913362,-0.6543389,0.34052885,0.47958153,-0.02415347,-0.1827007,-0.34618455,-0.01685995,-0.12551555,0.525249,0.43769217,0.45401025,0.4392505,0.31412756,0.24649619,-0.9297729,-0.5676157,0.17195375,-0.27104977,0.85674256,-0.34655598,-0.3624852,0.30684638,0.5001061,-0.99613357,-0.8069341,-0.06585088,-0.8618384,0.63398546,-0.07328355,-0.949641,-0.02086955,0.25592142,0.4653414,-0.17191632,0.23273528,0.68858236,0.6379395,-0.04451239,0.9845092,-0.16102998,0.8496691,0.5791951,0.39268252,-0.48861063,0.5747073,-0.036963046,0.69515634,0.9212379,-0.8146251,-0.1419737,-0.6029448,0.121207945,-0.99979573,0.39293483,-0.48244807,-0.35764945,-0.6838473,-0.2717067,-0.28549463,0.3038805,0.084287405,0.33928347,0.9965207,0.13784596,-0.39639702,-0.016572496,-0.23783578,-0.4505637,-0.75351095,0.19437422,-0.70844954,-0.21224347,-0.003469222,0.99994105,0.12231758,0.6243326,0.6321015,-0.18759108,0.24561249,-0.9358953,0.22567782,0.88277864,-0.6340062,0.57286763,-0.9999912,0.70878446,0.9537491,-0.26117918,-0.60995555,0.02936632,0.23062715,0.32186925,0.5523167,0.027241508,-0.25289014,0.9001263,0.74818844,-0.002899997,-0.21074608,-0.21239784,-0.60495484,0.9133949,-0.8814705,0.79061556,-0.91791415,-0.4355143,-0.34127676,0.30796766,0.48610672,0.42437375,0.6081669,-0.3711755,-0.007131136,0.3818751,-0.08496408,-0.687669,0.2729032,0.62392795,-0.123851426,-0.943761,0.7753756,0.5824031,-0.087321356,0.16420016,0.45569125,-0.20722324,0.13223566,0.67626464,-0.65863127,-0.14568582,0.1539327,0.46215263,-0.45132467,0.16892385,-0.4720108,-0.29977113,0.45968473,-0.34422207,-0.2851869,-0.48024577,0.50774306,-0.3336937,0.31701174,0.63866025,-0.79611397,-0.7816626,-0.3678857,-0.3873571,-0.13189557,-0.48528036,0.024709772,0.006864885,0.10660488,-0.99960953,-0.48663902,-0.3709544,0.1577149,-0.4479369,0.21392952,-0.15243743,-0.15957554,-0.06607185,-0.2634015,-0.4990608,0.284527,0.13307449,-0.64953464,-0.12985805,0.997168,-0.2712442,0.54920906,0.39815313,-0.19019939,0.43834445,-0.46730322,-0.61526346,0.5514617,-0.5536709,0.19136342,-0.376344,0.36823273,-0.07873194,-0.34486002,-0.009509002,0.9221122,0.8105688,0.4704725,-0.7195467,0.095395595,-0.1336105,0.78065807,-0.37850225,0.34926778,-0.42102528,0.4450766,-0.97521085,0.15476696,0.5978966,-0.36151356,-0.47781444,0.20467791,0.43069777,0.41941965,0.2197721,-0.5442624,0.8939473,0.6930213,-0.7564329,0.7122193,-0.4318437,0.19118746,-0.41296625,-0.6022453,-0.6091516,-0.062347867,0.73952353,0.4594999,-0.5078644,-0.4952256,0.49618587,0.2802527,-0.30419314,0.46458408,-0.77074766,0.35428065,0.99899065,-0.31033796,0.67309934,-0.22253929,-0.54802585,0.13983887,-0.068784356,-0.9548366,0.17501293,-0.4636134,0.9903364,0.5784832,-0.25403985,-0.029425124,-0.3017757,0.9999965,-0.9957242,-0.041382167,0.6686195,0.44107825,-0.27785563,-0.1382476,0.6860422,-0.29047087,-0.5547593,-0.020041397,0.28348583,0.5196068,0.38417393,0.6652363,-0.36518738,-0.45983976,-0.20653638,0.7936813,-0.33479548,-0.011319446,0.15241082,0.9777653,-0.22162886,0.13238503,0.2618585,-0.23808548,-0.88572663,-0.60452724,-0.026224138,0.5462401,-0.9823141,0.4232442,0.26581725,-0.33188662,-0.47832087,0.54511,-0.026303131,0.4309196,0.7124085,0.67112017,0.05023051,0.5264205,0.31326798,-0.49429196,0.2598424,-0.40139255,0.10610469,-0.24404243,0.2100971,-0.8170224,-0.31717885,-0.79296225,-0.4052318,-0.9885156,0.037925337,0.3831295,-0.7034866,-0.2570284,-0.21967272,0.10910633,0.99954104,-0.13759552,-0.6231437,0.26599962,0.6452684,0.17791335,0.29306495,-0.8239732,0.3967904,0.15245949,-0.07652027,-0.68287903,-0.38967708,-0.20436354,0.4892692,0.2177642,0.5153347,-0.34881112,0.99767005,0.41762084,0.08189241,0.13342597,-0.2514062,-0.21891141,0.16375595,-0.6897615,-0.44082832,0.059527215,-0.25957194,0.5538883,0.7865452,-0.2603469,0.44141716,-0.0720797,0.46290398,0.030089786,0.09564906,0.6070762,-0.09163464,-0.7557754,-0.26827362,-0.1238986,-0.044084456,-0.3235404,-0.646086,-0.41986388,0.08635664,0.08372736,-0.3178032,-0.16037102,-0.6884027,0.58117443,-0.22484002,-0.047861848,0.56390566,0.4277549,-0.1954545,0.005518104,-0.15663244,0.8360361,-0.23157969,-0.98803335,0.36563453,0.9995853,-0.38269964,-0.34753898,-0.98135847,-0.40622115,0.02293861,0.265858,-0.15682074,-0.19167018,0.07567124,-0.56648123,-0.85815173,0.16808015,0.014338587,0.13827775,0.18985182,0.48822713,-0.6720465,-0.99997354,0.9975074,-0.81715983,0.11964947,0.5431701,0.13475335,-0.45282063,-0.6562851,-0.7377946,-0.02159604,-0.5931361,0.21910301,-0.57136136,-0.44740352,-0.34937936,0.62420547,0.38323572,0.002829603,-0.44181234,-0.29164967,-0.9999234,-0.4693659,0.02853088,0.198153,0.56488615,0.5460068,-0.9794844,0.44137597,0.003609798,0.11165815,0.16723156,-0.24415144,0.6407219,0.9189522,-0.66133106,0.7034501,-0.40921822,0.2933266,-0.6400615,-0.81729037,-0.41461873,-0.45323655,-0.6367308,-0.7164733,0.69910485,0.12952434,-0.5705414,0.08195451,0.09856344,-0.4152742,-0.007760642,-0.6960123,-0.24318704,0.23531258,-0.22296998,0.9283688,0.24902318,0.17828116,-0.4055693,-0.4151497,0.33094323,0.99980843,0.6081891,0.37647322,-0.42866173,0.40682667,0.37632287,-0.6842547,-0.9642802,-0.62403876,0.23569502,0.55098176,0.4675473,-0.61385006],
    [99,1,"COP(=S)(OC)Oc1nc(Cl)c(Cl)cc1Cl",0.8643498,0.15548536,-0.7422898,-0.31894657,-0.03834684,-0.5887635,-0.9675326,0.20049393,-0.63512677,-0.42898452,0.2237623,-0.21842436,-0.105201416,-0.48011655,0.37433696,-0.7813701,-0.56444067,0.3112633,-0.54979473,-0.3906484,0.40217626,0.087606765,0.014218381,-0.17395753,-0.43574455,-0.07933372,-0.09346066,0.26950473,-0.105244935,-0.33463815,-0.11455154,-0.22650793,-0.4822229,0.13245635,0.69520664,-0.75640464,-0.1373437,-0.44639653,0.9829491,-0.8917235,-0.9600717,0.014673026,-0.23314525,0.087178074,-0.25788483,-0.9273814,-0.33903962,0.05323147,0.9866605,0.21436353,0.10189146,0.1737764,-0.1466467,-0.058979534,-0.7802414,0.4859054,-0.8055901,0.49239722,-0.032801095,0.19687574,0.63045776,0.5766339,0.32773304,-0.30968967,-0.84588337,0.60201764,0.2279481,-0.14219186,0.09074822,-0.2162426,-0.48667264,-0.8747705,0.10575357,-0.06684066,-0.3911471,-0.9473307,-0.51521415,-0.6032903,0.78454953,-0.9994261,0.42542654,-0.33185107,-0.89153045,0.28500372,0.35448968,-0.4385716,0.03276578,0.06724195,-0.036847867,-0.36669523,0.20105708,0.58849376,0.25024056,-0.49651206,0.9981646,0.07857253,0.20742856,-0.31465462,-0.3353608,-0.85457504,-0.03319404,-0.26589426,0.32854447,0.08450767,-0.62513167,-0.98194623,0.19083592,0.61766106,0.9843102,0.6940067,0.007820446,-0.6826033,-0.47789773,-0.6598725,-0.10292333,-0.12510288,0.42942247,0.4086956,0.9991259,-0.5484818,-0.6078346,0.614394,0.4856029,-0.340247,-0.4447341,-0.3570373,-0.032437693,0.016278233,-0.040468883,0.99839395,0.15638883,-0.57498235,0.5136526,-0.45361388,0.09584993,-0.9722086,-0.47433057,-0.27766973,-0.5313609,-0.5118115,-0.9962989,-0.6089969,0.9327539,-0.029325547,-0.39466086,-0.646545,-0.26604488,-0.26395166,0.57374,-0.26332203,0.7709209,-0.84622264,-0.34741613,0.00037014,-0.8261351,0.3410919,0.25279158,0.9869121,-0.7664018,-0.96416557,-0.95917004,-0.68518597,0.3459065,0.3751784,0.085619636,0.09041175,-0.09644162,0.119871214,-0.5364943,-0.14271331,-0.036265004,-0.21400364,-0.41901854,0.14345239,0.4067525,-0.51863265,-0.6230853,0.68352747,-0.67876804,0.6523577,0.83705807,-0.9265653,-0.06746788,0.7525082,0.006715106,-0.13182822,0.4907516,0.13348317,-0.28995985,-0.4970588,0.67230344,-0.27390185,-0.11741902,-0.18277326,-0.29560077,-0.004988774,-0.6515574,-0.8230227,-0.19818059,0.619237,-0.30856457,0.5699185,-0.795462,-0.59509075,-0.23417394,-0.581702,0.6125231,-0.5547959,0.22460702,-0.99915063,-0.17225991,0.030747494,-0.6315511,0.6215514,0.5338136,0.46634147,-0.50104237,0.35260022,0.12635115,0.32865748,-0.6700348,-0.5822657,0.46530637,0.19618031,-0.9890276,-0.627761,0.51759386,0.24066602,0.627312,0.550417,-0.36320886,-0.16412924,-0.009936787,-0.6636832,0.312967,-0.054754727,0.30299225,0.3152431,0.36153066,-0.5694233,0.8751514,0.019590804,-0.17792854,0.0371326,0.41263878,-0.389936,0.84700114,-0.66724145,0.65416193,-0.27019534,0.5034235,-0.9985812,-0.44595343,0.6168556,-0.73700786,-0.41851592,0.108729176,-0.2339421,-0.7365943,-0.2582686,-0.03853352,-0.24089149,0.5023278,-0.0783245,0.24885656,-0.35097238,-0.62126356,0.38089374,0.39478314,-0.32373253,0.89554054,0.9981715,-0.5511094,0.73782927,0.7843096,-0.6827995,-0.60951006,-0.51820755,0.6317607,0.08197742,0.14588377,0.99827147,-0.75049627,0.29091093,-0.46459582,-0.567184,0.27114886,0.78916305,0.924461,-0.7584944,-0.52463794,0.9982585,0.43890244,0.7733357,0.013557809,-0.26647717,0.9961851,-0.9300318,0.57815665,0.5104635,-0.00140077,0.4164745,-0.34031394,0.4097757,0.4098864,0.6088446,0.8616408,0.7878601,-0.47999644,0.42007583,0.44797546,-0.0762783,0.090423256,0.06635248,0.1155778,-0.1127352,0.40273264,0.55468154,-0.9999433,0.7062418,-0.09759522,-0.2668659,0.26017526,-0.8804922,0.53561723,-0.5425489,0.06557074,-0.5712146,0.3644882,0.29961088,-0.1266216,-0.38133234,-0.08189196,0.249474,-0.26564887,0.1725774,0.40551123,-0.48204935,0.056769982,0.45208165,-0.27669325,-0.81766236,-0.73546106,0.05749381,0.48505217,0.09399595,-0.20988621,0.698043,-0.15414147,0.4158418,-0.97498167,-0.32872593,0.65042883,-0.5849511,-0.03628484,-0.33438385,-0.053741142,0.99975514,0.21167,0.41135377,0.5645943,0.5336866,0.6256171,-0.5104806,-0.52790225,-0.7241005,0.4693305,0.4859762,0.31884363,0.49586597,0.32080036,0.8496372,0.35990852,-0.14422016,-0.19598456,1,0.23990367,-0.17324719,-0.07031456,-0.057717763,-0.66369224,-0.3508637,-0.14727844,0.10875612,-0.34444538,-0.5860423,-0.27480343,-0.3016714,-0.85375595,0.6403105,-0.1174137,0.6016736,-0.4876835,0.2077465,0.18331668,-0.91870433,0.2714032,-0.004713079,0.5717907,-0.513815,0.2827299,-0.3732639,0.22595531,0.4186063,0.37539428,-0.028456347,-0.27280965,0.55672115,-0.0717612,0.102484584,-0.70089734,0.4186323,0.8234736,-0.16919193,0.38235286,0.12702946,0.9999999,-0.7466227,-0.9797226,0.2404913,0.9994617,-0.080337405,-0.43736118,-0.99992454,0.08097996,-0.33463508,0.37795436,-0.73622835,-0.22385927,-0.50376475,-0.47921753,0.30965453,-0.61825883,9.91e-05,-0.50407875,-0.2909876,-0.14160599,0.33800563,-0.99997544,-0.9986758,-0.9864868,-0.271793,0.371846,-0.4743247,-0.103077546,-0.058104422,-0.67428935,0.20500156,0.6460989,0.7727384,-0.40677163,0.081712544,-0.011198351,0.48798734,0.7214377,-0.28164256,-0.025848856,-0.818462,-0.99982506,0.060233258,0.58263505,0.39452645,0.037740055,0.33228564,-0.76074946,0.57161033,0.5576765,0.20943065,0.53041005,-0.791095,0.58918,0.9011668,-0.59154004,0.39871183,-0.6399144,-0.12812044,-0.26440194,0.19547738,-0.646822,-0.10917684,-0.7322171,0.16332026,-0.98564893,-0.47034836,-0.5223954,-0.32123128,-0.43840504,0.24588025,-0.35054496,0.8022218,-0.33714095,0.82583815,0.6997302,0.61629075,-0.010135154,0.28053674,-0.110452496,0.14789693,-0.4718234,0.9999465,0.8992486,0.6011013,-0.16803999,0.60197866,-0.4865689,-0.062581524,-0.920579,0.21805836,0.28994358,0.5655777,-0.5159493,-0.106114164],
    [100,0,"CN(C)C1C(=O)C(C(N)=O)C(=O)C2(O)C(=O)C3C(=O)c4c(O)cccc4C(C)(O)C3C(O)C12",0.85766214,0.041369274,0.57808244,0.180624,0.15342343,0.5937883,0.63174,-0.33587062,-0.013081948,-0.71527207,0.18367127,-0.45397386,0.41554192,0.58575857,-0.09193627,0.80481166,-0.5701808,-0.80640924,-0.02030966,-0.52216315,-0.13733527,-0.14802882,0.33856487,-0.09032372,-0.013460045,0.1051831,-0.2186368,-0.52201295,0.011344347,0.76546586,-0.8384755,-0.7964951,-0.14637953,-0.45714778,-0.06130565,-0.5658696,-0.10315788,-0.11987198,0.9998865,0.8770454,0.9707689,0.47560555,0.19258167,-0.66928357,0.3100184,0.98439986,0.7191392,0.19092688,-0.23181313,-0.3571085,-0.75149024,-0.24703853,-0.40551835,0.31601816,0.8211575,0.29259634,-0.13800341,-0.9965646,-0.5620153,-0.60407364,-0.20569488,-0.26636025,-0.25442857,-0.09368072,0.7560074,0.17807361,0.2584674,-0.7085274,-0.13445537,0.05792663,-0.93713427,-0.9997232,0.42580104,0.8778051,-0.8447613,0.7573554,-0.0799038,-0.48276466,0.22340773,-0.9978895,-0.9742526,-0.6582306,-0.9695215,-0.5075288,-0.6609245,0.82285875,0.73671967,-0.9256243,0.27923062,0.8004391,-0.7176917,0.51898366,0.46370965,0.09817038,0.9999773,0.16053843,-0.96794987,-0.8554759,0.7879128,0.22820221,-0.4734404,0.03082701,0.3448454,0.008308481,-0.9999739,-0.20448859,-0.0704575,0.037275836,-0.9999976,-0.5338836,-0.6896647,0.4765863,-0.8113735,-0.44031173,0.6253282,0.23148617,0.34253165,-0.47407135,-0.04122485,-0.31669825,-0.23815987,-0.4309876,-0.53915226,-0.11841332,-0.18580821,-0.5399064,-0.47666615,0.33742845,-0.021347042,0.70988476,0.54739517,-0.45143834,-0.12641993,-0.023359107,-0.55903745,0.9735571,0.6395238,0.09543464,-0.5587062,-0.87487197,-0.99999356,-0.18993747,-0.9872076,0.6759455,-0.24308434,0.00835725,0.802811,0.14755218,-0.99997276,-0.38152695,-0.3327746,-0.7753182,0.24821106,-0.24168234,-0.2451106,0.009918006,0.29513368,-0.9994864,-0.9137232,0.17702493,0.8038224,0.3690273,0.24941094,-0.286283,-0.022242451,-0.12928106,-0.1611425,0.82501435,-0.475173,0.025643436,-0.6737416,0.088168554,-0.078539476,0.5141109,-0.59722096,-0.08181488,0.5012828,0.13718654,0.5406106,-0.19888844,0.33099937,-0.999943,-0.42210138,-0.47812518,0.9991272,0.7469046,-0.097683944,0.49270707,-0.20292027,-0.3634482,0.93193537,0.13200726,-0.12533846,0.3278443,0.4826484,0.21715333,-0.5272441,0.56716025,-0.7488019,-0.5134328,-0.512896,0.51518214,-0.14818753,-0.66928816,-0.5360053,-0.5134827,0.69584984,0.90334064,0.71306896,-0.99979496,-0.6915835,-0.6962238,-0.18627812,0.002777375,0.6258388,0.21544315,0.057502836,-0.047623,0.22793578,-0.30098093,0.714243,-0.12322885,-0.2718796,0.37534177,1,-0.19661868,0.24830993,0.29967946,-0.5669803,-0.711146,0.6781227,-0.3089236,0.7158121,0.38686895,-0.8229908,0.11541106,-0.43465137,0.30151957,0.573258,-0.35932657,0.8094644,0.37911776,0.1256525,-0.48671785,-0.7874983,0.70189273,-0.3414471,0.13041776,-0.04331028,-0.93721807,-0.61537987,-0.3863821,-0.12240458,0.4500475,-0.4706664,-0.7839348,-0.70142365,-0.3268952,-0.51639163,0.16040555,-0.28110632,-0.3213509,-0.32066488,-0.62105966,-0.12009249,0.39427343,-0.2574139,0.18243979,-0.88517857,0.13569918,-0.2399809,0.99991846,0.65833116,-0.8386068,0.39603814,-0.38123676,0.4053462,0.46840125,0.35436642,-0.7238235,0.37718353,-0.43325892,-0.28312916,-0.9562905,-0.12832819,-0.7767036,-0.7099063,-0.96763074,-0.99967694,-0.46198112,0.70047754,-0.9745167,-0.3251158,0.82064545,-0.24291009,0.022323212,0.9999989,0.92143,-0.07770748,-0.8973045,-0.51767427,0.19201714,-0.036907066,-0.21167725,-0.6128145,-0.6872706,-0.9996683,-0.48900518,0.2693079,-0.11342315,0.46167547,-0.2536865,-0.008116663,-0.4071293,-0.9925576,0.002891508,0.14622724,-0.01740351,0.9999985,0.092630476,0.16362919,0.7452263,0.124215834,0.59231466,-0.35356364,0.38620126,-0.94269305,0.9340226,0.1282141,0.50747603,0.1746248,-0.37294012,0.4899352,0.4990541,0.5454214,-0.99426657,-0.43755698,-0.4395347,-0.54466015,-0.35838494,-0.6012335,0.3253052,0.6234827,-0.31695864,0.10289152,-0.7799217,-0.03767546,-0.2528679,0.73936296,-0.9966567,0.98182446,-0.000991672,0.8206801,0.44584262,0.05884312,0.41842,-0.61455965,0.9983549,-0.124647,0.9605179,0.36228782,0.6919305,-0.42270923,-0.30169252,-0.48117486,-0.47497836,0.32937407,0.9653645,0.2288998,-0.12978536,0.22128916,-0.5342861,0.79181755,-0.918133,-0.14110877,-0.9999795,0.65765727,0.515685,0.6264044,-0.73140645,-0.43091023,-0.062483877,-0.8566465,-0.45536584,0.35118175,-0.08544374,-0.7367257,-0.20786272,-0.23861022,-0.5022087,0.8879113,-0.66190666,0.7015142,-0.18799064,0.21920168,-0.4842769,0.12794,0.7488711,0.7214621,0.9406523,0.9998476,-0.24592781,-0.34794828,-0.7039554,0.27430147,0.33537954,-0.6534193,-0.3516513,-0.2196086,-0.3904686,-0.67631125,-0.3298389,-0.7538199,-0.37336907,-0.059966028,-0.08540009,-0.999856,0.48747975,-0.9738039,-0.75878024,0.9996436,-0.7549346,-0.13493918,-0.20140696,0.005138981,0.13718417,0.11850348,-0.015334497,-0.60700375,-0.08913476,0.08946224,0.83562404,-0.18642575,0.3068005,-0.21699975,-0.07757669,0.18490416,0.3149534,-0.99743885,1,0.9210633,0.75016576,-0.16093232,0.9439068,-0.150266,-0.30045006,-0.7066707,0.13737053,-0.691643,0.75430703,0.1965003,0.09484061,-0.6265059,0.11180989,-0.3943062,0.03852068,-0.015337194,0.98838925,-0.95150375,0.5333393,0.8026182,-0.7391888,0.14079508,0.102910176,0.9992826,0.6630161,0.2528495,0.57667464,0.16063242,0.7591031,0.6408799,0.7225972,0.07764007,-0.6965503,0.40333933,-0.53985626,-0.6672326,0.08704558,-0.23464632,0.60089695,-0.5304883,0.9349416,-0.9998711,0.4353787,-0.8628862,-0.19462034,0.48360115,0.9319505,-0.27086708,0.073939055,0.4531771,-0.40639958,-0.6607244,0.9990736,-0.16188626,-0.28263336,0.34471887,-0.3436736,0.18607113,0.99996126,-0.91501015,-0.15550984,-0.59472275,0.06354882,-0.013906056,-0.71636605,-0.9993875,-0.8533729,-0.67663455,0.47654715,0.9379726,-0.5733916],
    [101,1,"CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc(O)cc2C1=O",0.58020425,-0.10254809,0.41039866,-0.038033612,0.53564966,0.17258994,-0.28334835,0.27423733,0.005758672,-0.10006624,-0.8570666,-0.4678221,0.32707074,0.13451555,0.23737311,-0.43864128,-0.6126272,-0.7696234,0.102103435,-0.85108906,0.21782385,-0.2476188,0.6352723,0.55627173,0.5614044,0.65754586,-0.14146748,-0.15003951,0.21123219,0.07946272,-0.40562448,-0.27768263,-0.15964647,-0.5534619,-0.30989784,-0.029985655,0.47116625,0.57478684,0.9993556,-0.5574751,-0.9705673,-0.5829994,-0.54406685,0.37549555,-0.09817143,-0.50904727,0.38787878,-0.48074022,0.8964245,-0.09094941,0.37458315,0.18162113,-0.0385725,-0.4735681,-0.6311198,0.27401808,-0.4971892,-0.7240286,-0.15505776,-0.13646777,-0.4293703,0.4547308,0.051668346,-0.43682283,0.07012063,0.60156864,0.18867852,0.55284494,0.49715137,0.27460578,-0.80952793,-0.6468687,-0.5405117,-0.37458298,0.7735797,-0.3419244,-0.069204435,-0.3607778,0.21367098,-0.9998423,-0.8789776,-0.13470806,-0.85466015,-0.4439509,-0.08769546,-0.9479434,0.17251135,-0.6605569,-0.3361045,0.18053275,0.32556432,0.03959262,0.46256626,0.59410375,0.99566275,-0.43784177,0.068524174,-0.567928,0.29196742,0.19032395,0.66748184,0.45917585,0.36415166,0.5762385,-0.9946215,0.036529638,-0.4528626,0.48613742,-0.9440193,-0.18848704,-0.72951293,0.48571452,-0.083670534,-0.41968605,0.75894,0.70025086,0.43816897,0.34405008,0.98598593,-0.3427741,-0.43346784,-0.34620464,-0.27085754,0.05498167,-0.81954527,-0.5707846,0.47188747,0.112656295,-0.19983666,0.9999352,-0.035259966,-0.15034623,-0.53607875,0.25161645,-0.7399355,-0.83215296,0.20227437,0.92095196,-0.6930732,-0.93970203,-0.9999977,0.48192883,0.84994954,0.8302375,-0.17980109,0.50254405,0.35680488,0.035244286,-0.90352523,-0.17229944,-0.63730925,-0.60425985,-0.007545804,0.1291531,-0.6706451,-0.3586354,-0.37644976,-0.40102035,-0.93964475,-0.4050284,-0.6933355,0.56559837,0.48061645,-0.277062,-0.09810198,-0.31978092,0.5941562,0.64263004,-0.10821197,-0.19950631,-0.24019442,0.14810231,-0.63635314,-0.49488372,-0.43695587,-0.95381707,-0.61980003,0.36588827,0.15466185,0.7405779,0.11138879,-0.8684593,-0.46836498,0.19219254,0.14556311,-0.29155827,0.06685678,-0.1348358,-0.739053,-0.5965223,-0.18378465,0.49826455,-0.50532484,0.6592479,-0.48665994,0.23519127,-0.27685633,-0.5726323,0.19697274,-0.07852793,-0.102697395,0.5701565,0.27167842,-0.12196743,-0.045651007,-0.08679108,0.5609989,0.5034997,0.25283456,-0.9999295,-0.5246486,0.19732305,0.42248085,-0.34072083,0.7001024,0.024908317,0.6991047,-0.58021986,-0.3988169,-0.10223541,0.83535135,-0.26974893,-0.807488,-0.5651406,0.99755675,0.1340691,0.6242485,0.43950304,-0.32371867,0.13067724,-0.10369446,0.30154124,0.74059737,-0.3156778,0.42873752,-0.15953201,-0.000544557,-0.71518075,-0.47146055,-0.41757324,0.9265892,0.5653705,0.20878379,-0.49868265,0.359091,0.5698374,-0.14230165,0.5293695,-0.055143002,-0.57357305,0.3037644,-0.7727339,-0.7150109,0.38092646,-0.1512126,-0.72209877,-0.42845207,-0.03537721,0.10381503,-0.06098679,-0.023068987,0.7874863,-0.3051365,-0.7169788,0.19859105,0.4723886,0.41397068,-0.019299356,0.10284606,0.36117005,-0.097592585,0.8167072,0.30265605,0.20422098,0.47135076,-0.45702097,-0.005637302,0.3757213,-0.8293104,0.016769273,0.7411134,0.9961342,-0.096301004,-0.4178278,-0.36551064,0.49697077,0.29698855,0.82344526,0.46586528,0.5340532,0.5659089,0.8151561,-0.15208937,0.7866317,-0.83269876,-0.56105214,0.9999999,-0.9922921,0.7535349,-0.34970585,0.34754625,0.6552392,-0.6674646,-0.6344673,-0.3267059,-0.7990463,-0.9671518,0.1825243,0.1709921,0.16819271,0.221207,-0.162903,-0.10976576,-0.19944328,0.3921927,-0.2319554,0.18623424,-0.07767333,-0.9739019,0.20308274,-0.52014005,0.3315638,0.32811564,-0.8644105,0.07619641,-0.119146645,-0.5708753,-0.97706735,-0.101096675,0.66907793,0.041882474,-0.3199772,0.053661782,-0.2117261,-0.2431233,0.81176794,-0.14409581,0.2283941,-0.028789997,-0.16789608,-0.46725288,0.6278449,0.55500036,0.413994,-0.53462976,-0.70163053,-0.5598182,0.23890914,0.16369613,-0.89554954,-0.90962523,0.424589,-0.7217305,0.13196863,0.63695127,0.2485071,-0.02495384,0.9997445,-0.56061697,0.09680669,0.13357157,-0.62905926,-0.40832603,0.03769388,-0.9327137,0.41803342,0.18004824,0.40604454,-0.76909274,0.25200993,-0.07531857,-0.2599289,0.65130764,0.164263,-0.34941417,-0.9861317,0.03493302,0.23443377,-0.7825675,-0.59730333,-0.30673796,-0.112301655,-0.63890284,-0.7276128,-0.42877802,0.018289655,0.35507306,0.11370703,-0.11022027,0.1721037,0.074185155,0.049360145,0.29748514,0.3266986,-0.17240141,-0.39004287,-0.41419816,-0.7411899,0.7073726,-0.19528596,0.52211094,0.6036157,-0.21394256,0.09803603,0.11371644,-0.60186756,-0.6779631,-0.027911851,-0.7318338,-0.36813653,0.527136,0.3112489,0.088881314,0.31611001,0.024426114,-0.31375307,0.99997044,0.63654006,-0.9600969,0.07564553,0.9998015,-0.20433398,0.32991707,-0.9993928,-0.4360455,-0.07046252,0.77961004,0.03822873,-0.5645811,0.27229002,0.3255315,-0.5747809,-0.21351546,0.6147353,0.102697685,0.42308033,-0.29875204,-0.22069004,-0.9999751,0.9999999,-0.37369522,0.3173081,-0.37869787,0.3469184,0.12864986,-0.535033,-0.8877614,-0.4268005,-0.6872256,0.003665715,-0.76410687,-0.4078167,-0.8844412,-0.7838103,0.3140657,-0.5123612,0.4595836,0.7011824,-0.9998485,-0.4543959,-0.62288415,-0.69141114,-0.24227715,-0.71999747,-0.9053763,0.3633244,-0.18158475,0.37257323,-0.18161647,0.7393867,-0.75600976,0.98435354,0.06623634,0.026335958,0.71747375,0.4207448,-0.5377961,-0.24687178,0.5270343,-0.7912022,-0.2569837,-0.37228945,-0.56837165,0.21559905,0.2639595,-0.6075473,-0.18339036,-0.35705674,-0.6622209,0.6433663,0.20555446,-0.04962356,-0.40548128,0.99544185,-0.1988477,0.45996726,-0.0749946,0.05305341,-0.4701499,0.99987155,0.7388657,0.18510504,0.38019204,0.22152662,0.2967678,-0.595919,-0.9953069,-0.37373146,0.44608867,0.052279066,0.7637074,-0.31315678],
    [102,1,"CCc1cccc(CC)c1N(COC)C(=O)CCl",-0.8910734,-0.38072687,0.12262263,-0.6275672,-0.60441476,0.29844007,-0.19143261,-0.54867494,0.02968533,0.3104402,-0.50943774,-0.39452448,0.7132897,-0.6815903,0.7104769,-0.43137458,-0.7171886,-0.63474834,0.51470256,-0.09126645,0.23053326,-0.34183457,0.16389051,0.21122088,0.5741211,0.43411,0.26063085,0.38505095,0.15522824,-0.50925934,-0.42998704,-0.49375796,-0.23709883,-0.65298533,-0.7921258,-0.39379853,0.49183592,0.34669217,0.9763927,-0.4916465,-0.9009552,-0.71492165,-0.5620115,0.50667167,-0.498713,-0.9735363,-0.6976417,0.56996185,0.99094766,0.31906828,-0.48668423,-0.2674738,-0.18334442,0.12008795,-0.88783216,-0.029010622,0.19463846,0.5667462,0.049283866,-0.6608183,0.08648929,0.7023902,0.26464552,-0.45042694,-0.28002313,0.7905226,-0.6786262,-0.06532613,0.44271538,0.6673648,-0.875449,-0.97640425,-0.3193246,0.36902413,0.84091944,-0.68198687,0.43353045,-0.054164205,0.45861778,-0.9998572,-0.21150798,0.61100656,-0.86105317,-0.06403984,0.59289855,-0.4507392,0.37820715,-0.2610835,-0.30877933,0.3221134,0.7582294,-0.47225896,0.3447079,0.27745184,0.9919672,-0.10672745,0.013097835,-0.12079309,0.44982585,-0.37116325,0.4506959,0.60172266,-0.8172031,-0.6268203,-0.60949624,0.19643271,-0.3761672,0.24656618,0.99222255,-0.7317329,-0.190468,0.59845454,-0.43556076,0.11155286,-0.22893298,0.289565,0.41967005,0.14686918,0.9986291,-0.63110965,0.111970134,-0.026924483,0.279976,-0.5325861,0.48261112,-0.5271641,-0.118850335,0.47092208,0.33708888,0.99939084,0.32500377,0.29641417,-0.4541333,-0.026429545,-0.4395434,-0.98594534,0.4850423,-0.55118483,-0.7157708,-0.88405746,-0.9924272,0.14752682,0.98320144,0.10611637,0.23423272,0.39400342,0.32380772,0.35733104,0.52032787,0.39522743,-0.040075846,-0.56319046,0.14113702,-0.24295962,-0.71927255,0.42658928,-0.44993252,0.963367,-0.8467016,-0.93074906,-0.9702017,0.37748662,-0.2884605,-0.2643222,0.48389712,0.7746251,0.4201223,-0.20839041,0.3072864,0.19095218,-0.28793088,0.57218176,-0.32271433,0.2613843,-0.28182328,-0.92726034,-0.69928074,0.25776243,-0.37000078,0.22866137,-0.5825534,-0.3908004,-0.53703094,-0.09373143,-0.33728623,-0.5504546,-0.18832076,-0.16370854,0.1544343,-0.008013724,0.15356669,-0.26680458,-0.068787456,-0.5147794,-0.7915193,0.1423974,0.45467937,-0.8590032,0.14406131,-0.26479164,0.15159929,0.48976108,0.6541074,-0.7831085,0.18352671,0.24156083,0.3703327,-0.23151138,-0.15927683,-0.99964553,-0.11952332,-0.04826081,0.48770165,0.19226044,-0.08413382,0.26671377,-0.09946701,-0.45231673,0.32686722,0.3154176,-0.01482315,0.014832574,-0.7712151,-0.7488104,-0.99300593,0.025963003,0.24881823,-0.025061468,0.4059196,0.48248038,-0.7297387,0.08468153,0.09369911,-0.60582703,-0.34809348,-0.72288215,-0.11167023,-0.6410256,-0.85948193,0.0256659,0.7866463,-0.3341027,-0.25448576,0.09133499,-0.45171675,0.38179585,-0.31261286,0.12969796,0.006771257,-0.35056317,0.6748151,-0.9988954,-0.5110255,0.46615234,0.5701633,0.1388622,0.5829647,-0.2693508,-0.370194,-0.017320966,-0.24153043,0.7801261,-0.4623652,0.5450394,-0.005341743,-0.042902276,-0.4468782,0.22893596,0.95762014,0.43887317,0.7178212,0.99754214,0.056377735,0.63959426,0.35110697,-0.8624408,0.36574805,-0.15716435,-0.943632,0.5627794,-0.20548002,0.9988287,0.16126819,-0.8174592,-0.38779807,0.5557523,-0.11625932,0.9031503,0.95928687,0.6637931,-0.09890737,0.99403787,0.58541816,0.9591584,-0.5350497,-0.8149378,0.9907959,-0.97175235,0.5036567,-0.14041285,0.11849186,0.3096507,-0.14039215,-0.07800801,-0.40104532,-0.75501674,0.5458344,0.14198339,-0.20223734,0.41158336,-0.4234511,-0.6096241,0.26724896,0.33765882,0.5742793,0.37068906,-0.51050794,-0.00878258,-0.99998826,0.30991703,-0.034215443,0.5017057,-0.36198676,0.02329304,0.60302275,-0.84891903,0.21162465,-0.8176211,-0.5840284,-0.13932495,-0.30465588,-0.40326983,-0.15971257,0.20881984,-0.43994346,0.22373807,0.2204668,-0.006448826,0.16866319,-0.35439253,-0.3039983,-0.4397014,0.6076474,0.4178482,-0.20543683,-0.14508331,-0.13379326,0.19816227,-0.35872552,0.31785095,-0.9843468,-0.19367985,-0.566538,0.55455506,0.81892866,-0.50258267,-0.735197,0.99984854,-0.7357881,0.042126942,-0.5523946,-0.84177524,-0.69610775,0.72737515,-0.7498754,-0.06352276,0.2234647,0.31643465,-0.75218207,-0.0954636,0.6055191,-0.84656054,0.19842254,0.32078642,0.27148083,1,-0.73987013,-0.2545833,-0.12939715,0.29085252,-0.27688175,0.87840796,-0.619416,0.09030711,-0.26252705,-0.12821326,-0.665993,-0.088621795,0.2829195,0.37216848,-0.15051398,0.4844759,0.312527,0.49454254,0.49246496,-0.8855221,0.14351813,-0.78655237,0.9326071,-0.6559301,-0.52694243,0.788722,-0.17013462,-0.16957934,0.3092557,-0.6860066,0.6145899,-0.7122854,-0.69224083,-0.048379034,0.20815092,-0.19259349,0.5373767,0.19029075,0.056009486,-0.69125324,0.9999998,-0.051705383,-0.95006996,0.8287228,0.9998369,-0.23227265,-0.3975205,-0.99994844,-0.43788424,0.3023259,0.29162052,0.11421064,0.6666968,0.54328126,0.6200296,0.08979985,-0.22147274,-0.6820526,0.4239076,0.09465254,0.75761354,0.22923666,-0.999978,-0.9980346,-0.97485584,0.06506158,-0.27435178,-0.522048,-0.3296382,-0.6982621,-0.9219971,-0.3952315,0.14171338,0.029032996,-0.55424213,-0.116059594,-0.30510166,-0.51356333,0.06759655,-0.5593262,0.024555936,-0.7563848,-0.99988467,-0.5074455,0.2217622,-0.6875725,-0.0588473,0.366361,-0.9625864,-0.16245224,0.45770434,0.09156435,-0.55016005,0.006892076,-0.8696639,0.90244186,-0.41595957,-0.062125005,-0.07523733,0.87118274,-0.43395644,0.46713012,0.55083734,-0.41119397,0.39900637,-0.29751715,-0.35764337,0.17386468,-0.002273824,0.14625783,-0.2363131,0.13540722,0.06811284,0.812317,0.5907563,-0.31056923,-0.29899955,0.85240775,-0.5227821,-0.5000744,-0.22418602,-0.48304027,0.08403566,0.99936175,0.69154686,0.28127214,0.75249034,-0.54537237,-0.6867024,-0.38639954,-0.9843545,-0.3689437,0.6930784,0.31109682,0.61562884,0.36213726],
    [103,1,"CC(C)(c1ccccc1)c1ccc(O)cc1",-0.7937107,-0.33717752,0.06354978,0.006644888,0.6644496,-0.41541153,-0.6708063,-0.10469924,0.06780976,-0.1691067,-0.8251369,-0.18819119,0.14214997,-0.74393886,-0.40329793,0.65057254,-0.16828398,-0.06370966,-0.08510626,-0.120899245,0.16134854,-0.8202777,0.55032665,-0.05505047,0.13555564,0.57183594,0.381519,0.085105516,0.82779926,0.24976711,-0.49705088,0.2676753,-0.01592496,0.2093411,-0.3766993,0.052879963,0.4187953,0.6484802,0.9316582,-0.9338288,-0.990145,-0.07327395,-0.043869693,-0.085011415,0.33539423,-0.9863556,0.06057348,0.012743575,0.96255934,-0.6457119,0.48803884,-0.11856267,-0.31272867,0.085835084,-0.9553682,0.32172096,-0.6458091,0.8060335,0.3031626,-0.1881895,-0.09172783,-0.50739485,0.5216563,-0.14161454,0.031001637,0.42924818,-0.15255933,0.55763185,-0.29614735,0.6509932,0.72617483,-0.82596695,0.038585123,0.082384616,0.7560049,0.113381036,-0.014456634,-0.46133384,-0.23120739,-0.99762136,-0.61930513,0.466372,-0.7814166,-0.3486686,-0.06995504,-0.83508474,-0.29080835,-0.29003078,-0.38052404,-0.3429077,0.30241117,-0.101955555,-0.026274106,-0.337516,0.4186941,-0.085275054,0.8501711,0.023571925,0.6310385,-0.37963986,0.18662341,0.18408288,-0.035770666,0.80177534,-0.25437397,0.58393455,0.37416655,0.53594583,-0.9027048,-0.04211312,0.031079067,-0.26637423,0.28002632,-0.11647641,-0.00718909,0.59855247,-0.04712809,0.4121875,0.9985809,0.23582533,0.056538153,-0.5842242,-0.40827504,0.17687166,-0.5766198,-0.00407193,-0.42637324,-0.20736243,-0.46680585,0.9999192,-0.5929397,0.23488103,-0.16738842,-0.1517175,-0.15911978,-0.7902868,0.3967606,0.83634716,-0.8219091,-0.57088274,-0.9999546,0.271075,0.99434114,0.35811713,0.0860876,0.26576132,0.17479353,0.09773718,0.8815638,0.31970122,-0.15088916,-0.75755423,0.32817113,0.13559192,-0.48037124,-0.35683402,0.004028123,0.98596346,-0.6374548,-0.44358665,-0.9844553,0.115962386,-0.31268895,0.21996588,0.08536421,0.31135708,0.78074825,0.6268099,-0.26791885,0.003270745,-0.49075913,-0.20011508,0.24401288,0.09352816,-0.45069656,-0.98912954,-0.7708907,0.4630465,-0.20509902,-0.5535334,0.010075805,0.6118936,0.23307246,0.6154852,-0.6814904,0.004944654,0.39269248,-0.20483442,0.10138789,-0.24492167,0.48630768,0.19145574,0.086964875,0.7390168,0.28474006,-0.563201,0.039175026,-0.28125864,0.61698306,-0.04393626,-0.23835607,0.024749894,-0.12071751,-0.27213308,0.47828966,-0.098007075,0.5391487,-0.30247602,0.21531212,-0.99794036,-0.4001479,0.15376057,0.529494,-0.04837035,0.58300495,0.3273653,0.14909135,0.39874914,-0.25394988,0.37747818,0.06566048,-0.43177807,-0.46275282,-0.45830855,0.99861497,-0.03588795,0.12834162,-0.10981826,0.20000449,0.37246072,-0.24447586,-0.17252511,0.7535867,-0.2444683,0.39570487,-0.40968063,-0.06645999,-0.18658262,-0.42267853,0.058594335,0.88004565,0.20149311,-0.12527166,-0.5506925,0.5673414,0.35728732,0.44665498,0.52784663,-0.025465153,0.18409045,-0.040198207,-0.97184694,-0.5411435,0.61093825,0.61023873,-0.25328502,-0.62829727,0.24564467,0.7138218,-0.39277261,-0.5622049,0.6072791,-0.57053477,-0.46592656,0.27220064,0.27555737,0.5408144,0.46500987,-0.49235994,0.22117981,-0.637143,-0.01982364,0.09538999,0.037995584,0.11561586,0.3508359,0.18332641,-0.44817388,-0.24610433,-0.3420046,0.30725724,0.99952865,0.13537978,0.47466722,-0.13866127,0.2820022,-0.4423141,0.43233365,0.6387529,-0.17854021,0.4919957,0.99789643,0.5152358,0.43267882,-0.14519183,-0.2306774,0.9999848,-0.99653876,0.5545401,-0.24059132,-0.13175006,-0.26084125,-0.37857196,-0.27654886,-0.22555733,-0.9260437,0.8739336,-0.06083722,0.32022223,0.12057514,0.10200365,-0.50134295,0.06850795,-0.3716186,0.91880244,-0.47658613,-0.22103317,-0.044878114,-0.9510565,0.18807252,-0.1567151,0.18459567,0.33646116,-0.55967015,-0.64420813,-0.13188554,0.39009202,-0.9633663,0.25528288,0.10615468,0.3956133,-0.000563614,0.4461685,-0.5426448,-0.2637399,0.82430047,0.16794805,0.4174121,-0.22439775,0.21513419,-0.43453297,-0.0869346,0.4247109,0.70021915,-0.0800747,-0.06467958,-0.3383804,-0.3814738,-0.5291266,0.62544376,-0.99469423,0.24211283,-0.5856002,-0.017451577,0.33432245,-0.26669797,0.41062513,0.9994619,0.060166996,-0.2634684,0.015313914,-0.32541078,-0.51902944,0.021251425,-0.9081774,0.2224327,-0.31788585,-0.4395769,-0.07263174,0.23108311,0.45423818,0.2054495,0.3043992,0.90887254,0.50355273,0.9987794,0.15473129,-0.26882124,-0.5393211,-0.13335404,-0.838767,-0.48674545,-0.40010872,-0.7097534,-0.16108572,0.095603675,0.5346647,0.1410839,0.28486586,0.5808796,-0.14656487,0.259148,-0.03645091,0.24069352,-0.07456515,-0.10669211,-0.7235383,-0.44860366,0.7123348,-0.45713738,-0.96237195,0.56006956,-0.26038054,0.25495958,-0.45065042,-0.50917363,-0.5916348,-0.7154877,0.07599761,0.13940777,0.5883658,0.19079642,-0.3634087,0.45138517,0.06587308,-0.3114504,0.99992555,0.20037945,-0.9866457,0.15299194,0.99937165,-0.63408357,-0.10535112,-0.9977402,0.06758895,0.27276278,0.5495936,0.42483395,-0.64565253,0.7938003,-0.42454538,-0.49262628,-0.3492846,-0.08969157,-0.3620583,-0.09802354,0.086178586,-0.19115913,-0.9999767,0.9827245,-0.95352596,-0.018265024,-0.54377484,-0.036809016,-0.1451518,-0.7465389,-0.6705719,0.2487523,-0.33047315,-0.28038886,-0.85797894,-0.6374612,0.01578666,-0.4485623,0.092489496,0.07717125,-0.25988007,-0.8513949,-0.99995077,-0.37320453,-0.21334589,-0.45363146,0.26822904,-0.33391815,-0.9976084,-0.060687754,-0.5170469,0.02235307,-0.354059,0.34833273,0.11055453,0.96989816,-0.19574748,0.5861801,0.5131662,0.37954056,0.29661667,-0.8976506,-0.10480112,-0.35793954,0.20061867,-0.3980435,-0.5398375,0.001262997,0.34549186,-0.6486833,-0.116365485,-0.55313987,-0.16131514,0.5748783,-0.32219237,-0.29523933,0.442247,0.46321595,0.29945865,0.049625233,0.030669918,-0.09153879,0.07496981,0.99954754,0.7777771,0.117009126,-0.038174868,0.26353946,0.06897745,0.014177782,-0.7627638,0.017335724,0.6658565,-0.11826294,0.73099303,-0.108731374],
    [104,1,"Oc1ccc(Cl)cc1Cc1ccccc1",-0.7195656,-0.31783682,0.46996674,0.4128956,-0.17810969,-0.4358693,-0.62244886,-0.30010703,0.4303654,-0.5724114,-0.72416407,-0.051551178,0.14410822,-0.8140264,0.033148836,0.42557824,-0.13759105,0.2166894,0.25684953,0.1722279,0.44340226,-0.8304313,0.13040979,0.47523692,-0.33628708,0.12528662,0.5141729,0.28952178,0.38236374,0.062040865,0.053539652,-0.048309594,0.3403157,-0.32595763,-0.27643123,-0.32772124,0.23274647,0.5073314,0.7121972,-0.9436352,-0.99153316,0.3798708,-0.06359709,-0.47438538,0.101789065,-0.99254763,0.26840517,-0.34816936,0.85883665,-0.32902858,0.43594047,-0.36741453,0.002517011,0.22068664,-0.9364271,-0.46184912,-0.4886725,0.9223259,-0.11052872,0.4551715,0.002923433,0.41849265,0.18907851,-0.1952455,0.086736396,-0.106524974,0.50766265,0.64888376,-0.23471506,0.3802788,0.5730756,-0.8799895,0.28767577,-0.25941065,0.7069945,-0.1779176,0.6103889,-0.5253657,0.19452253,-0.99717176,-0.6473244,0.5063135,-0.7281889,-0.50769174,0.03741495,-0.813577,-0.5222227,-0.15131143,-0.39863366,-0.3161893,0.41283086,-0.31755227,0.043983582,-0.22267546,0.04765207,0.37631372,0.7864501,-0.40870777,0.20768136,-0.30797207,0.6280757,-0.22342159,-0.078664996,0.84361106,0.5831646,0.49582782,0.27407444,0.3186612,-0.8632817,-0.07565009,-0.19046848,0.17983937,0.015311321,-0.107756935,0.32870632,0.72975934,0.7338424,0.14087373,0.9986418,-0.16661352,0.21190192,-0.3230527,-0.20650716,0.6343548,-0.39522955,-0.3138818,0.13239218,-0.11026432,-0.36661607,0.9999378,-0.091426276,-0.12754045,0.67470235,-0.3363585,-0.10780998,-0.6962188,0.7496778,0.8041802,-0.7369277,0.20160364,-0.99995464,-0.2501692,0.99564356,0.28454635,0.5399725,0.15511245,0.09425876,-0.113702565,0.97078216,-0.32890144,-0.11733055,-0.48693293,0.41388628,0.6924424,-0.1349758,0.006687794,-0.44771546,0.9958231,-0.35403693,-0.29788288,-0.9864059,-0.33057836,-0.22685023,0.20639239,0.29508504,-0.19086833,-0.28356072,-0.06508827,-0.2036725,0.25855178,-0.38210064,-0.18389073,0.10949609,-0.3122286,-0.051916547,-0.98478395,-0.6484925,0.45458075,-0.4229076,0.42733917,0.06754383,0.5851107,0.2618795,0.13667183,-0.8846149,-0.3888291,0.4382655,-0.02487306,0.29099426,-0.14032137,0.45258263,-0.2720599,0.255037,0.56352836,-0.55707544,-0.14228709,0.6170558,-0.5626599,0.76987326,0.5558463,0.189097,0.10888899,-0.7819099,0.16055685,0.43858993,-0.36733258,0.4052044,-0.56674457,0.210711,-0.9950078,-0.45103014,0.04730659,0.10753416,-0.012068563,0.15749486,-0.2999104,-0.23439546,-0.41750252,0.21909556,0.49073833,-0.29842028,-0.02961467,-0.5293033,-0.6045138,0.991683,0.4720913,0.07923133,0.29599655,0.06869262,-0.25925872,-0.13837554,-0.23877472,0.444477,-0.29293543,-0.037464406,-0.6111067,-0.30122635,0.23012558,-0.36545888,-0.29394877,0.8888307,-0.14232954,-0.1354671,-0.667999,0.7786094,0.026310934,0.419993,0.109599784,-0.026286578,-0.12913197,-0.1941693,-0.9682313,-0.1955272,0.4823729,0.22627069,-0.21087784,-0.021458004,0.3721175,0.003768601,-0.07425957,-0.4242313,0.22646877,0.20822863,-0.4334267,0.5313011,0.29170978,0.024797235,0.030260982,-0.5480061,0.5022266,-0.476572,-0.50192845,-0.373969,0.30704927,0.58448505,0.8860037,0.28881055,-0.14081301,-0.1490171,0.24858977,0.46566877,0.99959606,0.14044459,0.7494517,0.32308003,0.15526845,-0.41237742,0.22166365,0.80194527,-0.28575882,0.29620168,0.9989514,-0.13251139,0.1994123,-0.41120875,0.4769903,0.99998385,-0.9937388,0.47388104,0.33384746,0.38678333,-0.21165472,-0.27900997,0.17306589,-0.13370523,-0.78705525,0.96132535,0.5300266,0.3720172,0.026182054,-0.18525696,-0.38299093,0.56741047,0.002851661,0.9409785,-0.66803503,0.32384682,-0.14837036,-0.9616386,-0.18036085,0.09914104,0.35802644,0.55586225,-0.73223364,-0.76320773,-0.15475568,0.41603684,-0.9569497,-0.19885789,0.32854417,0.12737495,0.005931617,-0.33160588,-0.3037855,0.60417944,0.7123868,-0.48173547,-0.22827154,-0.46524134,0.1507624,0.35069835,-0.06499651,0.23078091,0.49636883,0.27367923,0.3613917,-0.20390767,-0.03524465,-0.37332487,0.79933304,-0.9972502,0.055289917,-0.15747136,-0.3347251,-0.07897521,0.10416137,0.060565405,0.99903303,-0.40219972,0.034056302,0.100289784,0.014867796,0.29274246,0.44195914,-0.9350813,-0.48212606,0.16247381,-0.7237045,-0.18646191,0.09929846,0.41369763,0.27384445,0.33454138,0.9428518,-0.014297595,0.99794006,0.23793226,-0.22583544,0.010249385,-0.29285806,-0.81480664,0.0719091,0.17498362,-0.6642358,-0.52189416,-0.1698377,0.07112142,0.3765753,-0.04924796,0.6855926,0.14837341,0.5255782,-0.5118692,0.21884377,-0.05829344,0.23595832,-0.26943722,0.11628147,0.47480935,-0.27202693,-0.96529144,0.39730775,-0.5036567,0.12652862,-0.23949756,-0.39236963,-0.27969447,-0.5923251,0.05996811,-0.17724952,0.45330164,0.4296425,-0.16894604,-0.09159221,0.147593,-0.42624286,0.99991935,0.2203369,-0.9800748,0.1887557,0.99946433,-0.45276523,-0.015893217,-0.9981608,-0.16900091,0.3068474,-0.09318557,-0.25869265,-0.33851904,-0.003806676,0.15473004,-0.07927191,-0.59611285,-0.62617034,-0.39188182,-0.60058427,0.3078626,-0.19389175,-0.9999753,0.98948926,-0.97042954,-0.37890834,-0.007822606,0.13143398,-0.19879735,-0.73001456,-0.711984,0.57333696,-0.39749077,-0.78655815,-0.80543447,-0.67930233,-0.05548283,-0.20262374,-0.17803022,0.064184844,-0.028076977,-0.9525073,-0.9999326,-0.6361802,-0.20094098,0.041859534,0.103690796,0.229581,-0.99749166,-0.17896509,-0.78349805,-0.3418412,-0.021415805,0.22005166,-0.36383003,0.9596068,-0.027652785,0.8461369,-0.0769621,0.6592452,-0.029990211,-0.7781721,-0.10516294,-0.20071068,0.19351697,-0.583831,0.13647455,0.015375718,-0.23639576,0.091868,0.010442208,-0.7610315,-0.16966899,0.49994785,-0.20676124,-0.15221393,0.15594733,-0.08396197,-0.038465574,-0.64452326,0.27177143,-0.36384296,0.057735965,0.9992616,0.5975407,-0.5574807,-0.054773115,0.1572381,0.5285005,-0.04813131,-0.3519159,-0.14472243,0.75137097,0.11068134,0.65359265,0.05732672],
    [105,0,"COc1cc(C=O)cc2c1C(COC(N)=O)C1(OC(C)=O)ON2CC2C1N2C(C)=O",0.6899882,-0.20224063,-0.06806835,-0.23846895,0.1600299,0.5304027,0.678626,-0.013537467,0.17414248,0.2703731,0.7692279,0.3144983,0.52405006,0.5799359,-0.2294673,0.08210338,-0.30407,-0.6341583,0.450415,-0.3359361,0.4834047,0.36733606,-0.69835216,0.616077,0.13505386,-0.7894359,-0.17267944,-0.27012575,-0.7955653,0.1595775,-0.001944831,-0.7183544,0.06551375,-0.2265632,0.33366844,-0.5900474,0.71221834,0.35825932,0.9999142,0.5661607,0.88729584,0.056511607,0.0470564,-0.30633098,0.21029311,0.9506996,-0.03593126,-0.5297026,0.9217431,0.14202197,-0.5745766,0.6491058,0.2512684,0.7801063,-0.000358805,-0.009067764,-0.25906664,-0.9634041,0.010270446,0.019967996,0.3986798,0.872239,-0.62298626,-0.30361322,-0.21392454,0.9582862,0.53414667,-0.53341657,-0.71718675,0.03707658,-0.81672806,-0.99796927,-0.0430567,0.56280416,-0.4280783,0.006926208,-0.7175131,-0.7354606,-0.59807134,-0.99990475,0.75611246,-0.63202983,-0.9824243,0.6021101,0.843537,0.44145358,0.5559901,0.2212465,0.12523733,0.59251356,-0.16959333,0.354707,-0.09008523,0.76220816,0.9999821,-0.2422841,-0.9002514,-0.03487788,0.12417465,-0.2593788,0.5968919,-0.36548468,0.29567784,0.13823497,-0.99990165,-0.5157867,-0.4273552,-0.803928,-0.2628173,0.109130666,-0.22142412,0.11717215,-0.048137486,0.15311068,0.79811615,-0.6165283,-0.7760693,-0.47177914,0.7711154,-0.3999872,-0.37394625,-0.09221754,-0.54535407,0.09242433,0.3275374,-0.72481465,-0.11018774,0.884166,-0.4553133,0.9094399,-0.28242642,-0.33230704,-0.59273446,0.48676676,0.002285497,-0.94851685,0.72579676,-0.9115157,0.5334496,-0.40179938,-0.99999684,-0.3313491,-0.9298706,0.42650944,0.7714256,-0.31101337,0.2751873,0.64735794,-0.99980867,-0.58390856,-0.009301162,-0.45022368,0.62501425,-0.6920553,0.62823474,0.35045692,-0.33862674,-0.9889472,-0.61218876,-0.9086584,0.32571894,0.44505584,0.25969315,-0.39396605,-0.31316385,-0.30581322,-0.5689216,0.33803147,0.056101564,0.3727009,0.23986186,0.58135605,-0.4619989,-0.3249395,0.48509616,-0.1842827,-0.02496863,-0.81037253,-0.19601215,-0.4640926,0.1655312,-0.99957556,0.14588773,-0.27080485,0.99348456,0.26809967,0.38884228,-0.09466652,0.3586907,-0.7233048,0.52264255,0.20488963,0.020396072,-0.07598183,0.12499705,0.20038788,-0.10220179,-0.5022489,-0.6420704,-0.07762835,0.37379265,0.6576198,-0.3758951,0.6424637,-0.38206527,-0.2789456,-0.06629529,0.25273654,0.694932,-0.99991083,0.5138111,0.6042563,-0.012448622,-0.19057283,-0.6049849,0.48490387,0.33410046,-0.55688906,0.5352868,-0.06952137,0.057713166,-0.2518839,0.19097279,0.17439756,0.6178923,0.5074339,-0.13759121,-0.075025775,-0.089155406,-0.06919798,0.23344514,-0.13254426,0.36907488,-0.7093737,-0.79040354,-0.16015936,-0.6114809,-0.57229567,0.14435968,-0.10171034,0.9013794,0.2873841,-0.70321095,0.23013316,-0.665938,-0.2198364,-0.21888882,0.539468,0.20125309,0.17950423,0.37631875,-0.39397985,0.29935265,-0.6494009,0.03282167,-0.54521537,0.2486587,-0.5907878,-0.69349796,0.6309759,-0.21788195,-0.04603029,0.36720687,0.53684646,0.36228642,0.062448233,0.4911166,0.29552752,0.8559006,-0.48808616,0.29137006,0.9999897,0.20967911,0.21968153,0.5800082,-0.7781255,0.6806573,0.21154302,-0.52337825,-0.36644125,0.31040433,0.77814597,0.11650186,-0.49945977,-0.83398384,0.28134078,0.08709651,-0.030010534,-0.7627347,-0.5602275,-0.13264395,-0.6775893,-0.43249163,0.89061195,0.3568299,-0.31242537,0.9999979,0.16818252,0.7369004,-0.6592327,-0.39132586,-0.060821794,0.2136432,-0.14621143,-0.09184267,0.13182214,-0.9987838,-0.8597411,-0.36414883,-0.15055096,0.027991816,0.17021206,0.03248051,0.13408144,-0.94294685,0.56415784,-0.14108847,-0.53856605,-0.9621656,0.35629714,0.50009763,-0.22093119,0.023284724,0.3819339,0.70508575,-0.72947776,-0.85597223,0.63553643,-0.54170704,-0.38786536,0.08819896,0.4541332,-0.113770775,0.116239674,0.006172074,-0.9228581,-0.31803748,-0.04828904,-0.3792346,-0.1979904,0.2509485,0.20899771,-0.19343686,-0.69283783,0.9031163,-0.602389,-0.28289086,-0.33166817,0.38842058,-0.99393,0.6551603,0.73845524,-0.67978066,0.52291185,-0.21024159,0.7144717,-0.28578267,0.9993504,0.38630152,0.7972801,-0.30876845,-0.47138172,-0.4737146,-0.51618767,0.3267089,-0.2343155,0.6866494,0.8059075,-0.5762355,0.40911826,0.7404337,-0.6311703,-0.14841995,-0.9407876,-0.29288363,-0.9999891,-0.49165204,-0.39128175,0.75408757,-0.49504972,-0.23013991,-0.17368264,-0.55011696,-0.2803456,-0.086557284,-0.12109191,-0.233015,-0.10944355,-0.20245846,-0.76897705,0.6266266,0.61601025,0.5953001,0.39016312,0.011243565,-0.29811856,0.14291857,0.5516213,0.7229004,0.6405618,0.99888384,-0.044779785,0.04222549,0.25576222,-0.063170634,0.64496994,0.5461514,0.42305836,-0.07001702,-0.026023848,-0.862538,0.18829708,-0.0865639,0.25904378,-0.37442207,-0.09559216,0.9998525,-0.5328307,-0.994956,0.5959677,0.98787606,0.021253584,0.5660392,-0.9986806,-0.09596661,-0.948819,-0.16991541,0.5592505,-0.001240305,-0.27765715,-0.57414234,0.8390061,-0.45093045,-0.46550077,0.16881071,-0.14285563,0.1900904,-0.74614114,-0.99946934,1,0.66652626,-0.1309819,-0.07312399,0.699083,0.007408558,0.31694114,-0.62202275,-0.7494845,-0.017180165,-0.73979163,-0.1090746,-0.57810366,-0.049341623,0.26144534,-0.7174376,-0.18836224,-0.15468314,0.9745447,-0.9954044,-0.5239723,-0.25742012,0.18239368,0.057549912,0.22067645,0.98570216,0.92672783,0.45728672,-0.25856903,-0.039585307,0.13782792,-0.7349987,0.31284848,-0.3786939,-0.022797266,-0.32836127,-0.48106056,0.63589317,0.8478296,0.36165336,0.222554,-0.23141365,0.95192385,-0.99976885,0.31570247,0.62396616,0.24619919,-0.5926118,0.68209636,-0.059212916,-0.4797592,0.30888835,-0.14577384,-0.72685176,0.99958414,-0.044790063,0.17925826,0.11322163,-0.01022379,-0.3073647,0.9995051,0.05681484,-0.68933773,-0.5937734,-0.21227767,0.41381148,-0.55559504,-0.9997692,-0.16709247,-0.04765926,-0.2576506,0.5360013,0.5911054],
    [106,1,"CCOP(=O)(NC(C)C)Oc1ccc(SC)c(C)c1",0.572074,0.019312916,-0.5712166,-0.40869966,0.5077686,-0.24604642,-0.9224686,0.17598176,-0.6056541,0.68197304,-0.565533,0.38575405,-0.37411326,0.00901814,-0.35044193,-0.65147203,-0.30212486,-0.6345347,-0.40622497,-0.38707992,0.10543338,0.06407409,0.28239045,-0.12966602,-0.74416894,0.55228114,0.09213381,0.46534973,-0.080456905,-0.04699361,-0.28476277,0.23417042,-0.75611454,-0.77707857,0.015299844,0.09148307,0.10697777,0.3830404,0.9942637,-0.7761909,-0.85521847,-0.22560549,-0.5180819,0.615447,-0.070346996,-0.853361,0.2644535,-0.23425493,0.9593376,0.27735826,0.8120658,-0.22467959,0.15855101,0.31773108,-0.7315208,0.30912435,-0.32536477,-0.049245834,0.35475,0.007721489,-0.2837228,0.10947072,0.5440551,-0.48635498,-0.6444798,0.52142924,0.0980347,0.60272807,-0.3226404,0.21254864,-0.81981117,-0.8793867,-0.21851571,0.37822434,0.5948966,-0.7631775,0.06588308,-0.59727675,0.4678479,-0.99964446,0.08631681,-0.6480117,-0.7744121,-0.41273353,0.43979603,-0.742631,-0.25148344,0.10120447,0.18202575,-0.42545652,0.002353321,-0.06408898,0.14835139,0.36781788,0.9936103,-0.26578462,-0.08792211,-0.033063,0.20585777,-0.28333807,-0.16911589,0.09625364,0.30851224,0.5415091,-0.938096,-0.78490305,0.24829283,0.47873923,-0.9218058,0.06027733,0.5741544,0.29165736,-0.07382613,0.14194365,0.011588445,0.2964871,-0.60170984,0.53953576,0.997961,0.20802343,-0.32865185,0.45985484,0.45016104,0.20062032,0.059145425,0.46352372,0.58110607,-0.50299746,-0.26097435,0.9995503,0.21594994,0.05671453,-0.2405195,0.10569194,0.21444413,-0.97743446,-0.41027874,0.15544099,-0.6781736,0.52376497,-0.9986565,0.069462135,0.90581167,-0.28849438,-0.42602915,0.008125255,-0.5381109,0.53038436,-0.14480034,-0.20299415,0.6285301,-0.12170506,0.2975055,0.21047175,0.41680223,0.28088862,-0.3667641,0.9017359,-0.791689,0.7371139,-0.8930065,-0.15605569,-0.24100721,0.030205764,-0.6479833,-0.4332298,-0.085985415,-0.14265622,-0.15242198,-0.32083046,0.15794739,-0.18203223,0.4627612,-0.085307695,-0.4224155,-0.82591,-0.52389824,0.10138669,-0.6248423,0.36178324,0.6533241,-0.8030894,-0.3342604,0.3113128,0.20856185,-0.15618631,0.4418457,0.07230613,-0.12888849,-0.5692898,0.028622404,-0.17158547,-0.06623928,0.26281172,-0.23363118,-0.37788722,-0.010487296,-0.8707582,0.28616485,0.33222437,-0.10070495,-0.5940111,-0.38652477,-0.77450365,-0.23151861,0.11766661,-0.46644017,-0.33891067,0.2170303,-0.99950224,-0.39617693,0.2765438,-0.33673924,0.11258643,0.13646185,0.22200246,-0.18315826,-0.25982302,-0.50513405,0.052633792,0.39822567,-0.49196225,-0.39991516,0.30821165,-0.98851645,-0.1391745,0.14729887,-0.09043381,0.3211522,0.41784418,0.1464107,0.15675384,-0.33238915,-0.25659528,-0.34620547,0.18611816,-0.1189389,-0.26135343,-0.24373583,-0.05246706,0.8755815,-0.047894128,-0.08072983,-0.4469417,0.39559025,-0.0932676,0.6944564,-0.51117235,0.45329684,0.15577993,0.4281515,-0.99840283,0.004931611,-0.107190914,-0.2684415,-0.21766965,0.08489351,-0.3291557,-0.03749539,-0.17188175,-0.34853277,-0.43177944,0.040489014,0.5228818,0.18062533,-0.23692083,0.091398835,0.64765936,0.4491544,-0.006849613,0.20246057,0.9976258,0.17772837,0.65895593,0.573357,-0.93294305,0.26329958,0.37796703,0.3937475,-0.21995726,0.044037394,0.9981066,-0.5646718,-0.24333985,-0.7310347,-0.115282334,0.6424524,0.49372858,-0.85152465,-0.5195507,0.031653132,0.99166316,0.11214914,0.8293969,0.724021,-0.53627574,0.9988455,-0.9722274,0.020190667,0.3254654,-0.45695177,0.37594002,-0.3042078,-0.82034844,-0.21270911,-0.21056835,-0.036330175,0.42273706,0.31694937,0.6520569,-0.3361748,0.49369112,0.054795407,-0.23810719,0.2753613,-0.099261954,0.4036342,0.02360605,-0.9635005,0.19635673,-0.04809934,-0.3678758,-0.004166154,-0.64932096,0.5142476,0.4397984,0.08046084,-0.8384533,-0.5104706,0.43808353,0.3452255,-0.003904858,0.032070726,-0.22957318,-0.00219827,0.34005073,0.16687536,0.3437467,-0.3557991,0.19030125,0.05119984,0.30874532,-0.5401951,0.54009545,-0.2629683,-0.5845657,-0.56024253,0.32577163,0.3463633,-0.28502792,-0.964001,-0.34838444,0.43755493,0.07653368,-0.4288612,0.24359517,0.32051465,0.99984443,-0.17099519,-0.186307,0.29598624,-0.16448858,0.014309242,-0.7770676,-0.8415718,-0.19635293,0.56797814,0.11464242,-0.14319184,0.13134058,0.7089354,0.49891308,0.03269564,0.2598365,-0.17352024,1,-0.5643545,-0.28589907,-0.10311855,0.6490693,-0.3438658,0.067539945,-0.2241054,0.40141964,-0.16580243,0.3462109,0.41999382,-0.14179082,-0.18799624,0.6333611,0.33072793,0.543001,-0.03251035,0.57694006,0.022915384,-0.8602403,0.6800102,-0.39450005,0.38129133,-0.717147,-0.17134584,0.27571264,0.5880415,0.43961474,-0.10625545,-0.26935714,-0.051418606,-0.52120394,0.13256855,-0.29951787,-0.63645554,0.71095717,0.55095875,-0.14735235,0.17286095,0.1860343,0.99995154,0.13469847,-0.9792509,-0.09047233,0.99975157,-0.0337392,-0.63663626,-0.99913543,0.16692863,-0.55265844,0.5300906,0.30826774,-0.2704999,0.046972487,-0.5800004,-0.29621124,-0.45910853,0.5203735,-0.28916293,-0.097433165,0.36708927,0.11593467,-0.99997514,-0.99709433,-0.9196666,0.07996419,0.5237927,-0.6079474,-0.40881336,0.19521184,-0.527187,0.29835343,0.7479829,0.50840324,-0.8014558,-0.1141617,0.22693747,-0.036785826,0.83929914,0.034864597,0.36183482,-0.3083762,-0.99985963,0.14273314,0.33076078,0.19430023,-0.31216666,-0.56174505,-0.9170114,0.266017,0.796925,0.5544865,-0.14253515,-0.94135916,0.28487197,0.94901925,0.2764531,0.22107033,-0.42351246,0.33320013,-0.22182044,-0.43591872,0.25408846,-0.18422239,-0.10417748,0.11927637,-0.85256475,0.23959146,0.050379433,-0.28214628,0.02272629,-0.44027218,-0.41560173,0.53764224,-0.34463456,0.29098368,0.6347589,0.9298254,-0.5114863,0.40703502,-0.29946548,0.27637807,-0.07907603,0.9999651,0.5385542,0.16006887,0.030694213,0.64204574,-0.3523896,-0.000512747,-0.97727156,0.28690115,0.09669873,0.2493168,-0.116387196,-0.46344674],
    [107,0,"CCOP(=S)(OCC)SCCSCC",0.9598125,0.1348341,-0.31810707,-0.05429966,0.66032636,0.5667936,-0.88855,0.13310714,-0.807823,0.5118728,-0.83893853,0.6732953,-0.5794572,-0.20140848,-0.050604343,-0.44458902,-0.73999316,0.18956329,0.40495285,-0.35656008,-0.060226656,0.03768658,-0.51855254,-2.49e-05,-0.2807811,-0.3464481,-0.40185872,0.32626772,0.13064583,-0.27458608,0.2808403,-0.57514197,-0.09136529,-0.7191674,0.07890133,-0.6630917,-0.20348683,-0.3893883,0.81908566,-0.91069424,-0.98381495,-0.52989787,0.30290633,0.50283897,-0.6762515,-0.9782992,0.13220362,0.33471692,0.98425794,0.28971013,0.5266251,-0.57153034,0.35519156,0.092944086,-0.7577592,0.20019092,0.5858584,0.8690808,0.40559405,-0.062793285,0.19823247,0.6202339,0.15656511,0.042227708,-0.31084922,0.5573615,-0.535956,-0.023561105,0.37211618,0.6379351,0.38544574,-0.93083864,-0.26486734,0.8235646,0.19747593,-0.8966254,0.5564225,-0.4474417,-0.07486681,-0.9995991,0.7755273,-0.22429995,-0.089794375,0.023540432,0.7027073,-0.106582895,-0.062247742,0.6890592,0.34395036,0.03384411,0.5448723,-0.53156346,-0.3315857,-0.35582173,0.99203604,0.6036234,0.4587481,0.26316234,0.13794763,0.43109277,-0.45554155,-0.16327709,-0.32718718,-0.3123287,0.413143,-0.9232762,0.015419723,0.5348078,0.99166304,0.33332846,0.18456545,-0.07046547,-0.44653234,-0.25689685,-0.018896427,0.011616796,0.12138943,0.42333964,0.9986811,0.23769882,-0.6445266,0.28493127,0.60528326,0.6685937,-0.56881565,0.48480135,0.15777157,-0.4331568,-0.55837816,0.9985722,0.34003457,0.33226895,-0.22643007,-0.78612226,0.68994606,-0.9884007,-0.69433343,-0.032323644,-0.039031826,-0.02626314,0.9991666,-0.38576517,0.96405345,-0.7459194,0.3297698,-0.020088345,-0.64716476,-0.47835252,0.88379866,0.5399927,0.47080225,-0.83803993,-0.15873787,-0.46328154,-0.2666775,-0.6735555,-0.46227938,0.9959672,-0.85025215,-0.897251,-0.9487758,-0.8247373,-0.044127215,0.17761575,-0.7877466,-0.33814862,-0.5874427,0.56232303,0.299737,0.21236393,0.226297,0.107096486,0.42361727,0.28048164,-0.6166985,-0.80742085,-0.56562996,0.26954055,-0.8018988,0.5463691,0.39236993,-0.81137437,0.64452845,0.79135585,-0.5739945,0.2851646,0.7808241,0.666546,-0.42436185,0.52955264,-0.06715695,-0.011685327,0.4246367,0.49106008,-0.33896726,-0.07048198,-0.6594093,-0.9016637,0.52303815,0.49078336,-0.43254158,-0.18405697,0.20312706,-0.637091,-0.6198643,0.24666908,-0.29346448,-0.8985728,-0.19731566,-0.99770856,-0.47142732,0.652729,-0.7126732,0.5766733,0.31499392,0.00765985,-0.76936096,0.40440804,-0.46574497,0.6655353,-0.2210283,-0.60709673,-0.22754925,0.572573,-0.986791,0.08898372,0.5295197,-0.38053736,-0.076855585,0.8454014,-0.4838116,0.013684643,-0.6784537,0.21719442,0.20317848,0.0880295,0.14603189,-0.32548207,0.18584806,-0.034070764,0.87923443,-0.4948086,0.14413238,0.6985007,-0.34269422,-0.4311099,0.59484977,-0.61352074,-0.679161,0.21338294,0.4231128,-0.9998017,-0.42408705,-0.24938446,-0.23877713,-0.22002158,-0.18272926,0.16530451,-0.7105576,-0.26276228,-0.16992503,-0.12738125,0.7732087,0.52971894,-0.6870918,-0.2203333,-0.63571846,0.35367998,0.27936155,-0.31081346,0.53482103,0.9930569,-0.53588945,0.46496695,0.8228329,-0.89797884,0.22372654,-0.47962356,0.1164395,0.8396721,-0.405733,0.9963093,-0.69439614,-0.08087799,-0.8043079,-0.30733547,0.14837687,0.7974482,0.90783614,-0.7230597,0.6155968,0.9988276,0.29423028,0.8855076,0.7832687,0.45058197,-0.99710715,-0.90571415,0.43272766,0.5864174,-0.31285793,0.5798288,0.09813748,0.48833296,-0.54488075,0.116223335,0.97479177,0.7466625,-0.37857386,0.2934649,0.7755883,0.21886657,-0.52904636,-0.43342096,0.4056643,0.63897586,-0.3283812,0.2888253,-0.9999461,0.18785281,-0.16451958,-0.6394838,-0.30832726,-0.9013272,0.8060054,-0.86773854,-0.2574285,-0.6493873,-0.1425567,0.36233646,0.29541233,0.38042876,0.62764096,0.15199377,0.054624707,0.026422556,0.25842538,-0.4786011,-0.081217654,-0.51996726,-0.23545988,-0.10789601,-0.48947176,0.678171,0.50910646,-0.4343784,0.06304388,0.76747406,0.13392231,0.7720309,-0.9813136,-0.71138066,0.4869412,0.3913488,0.31686008,0.111755945,-0.003600096,0.99972814,-0.6671803,-0.033340085,0.58004636,-0.59721965,0.5884411,-0.75910443,0.08487125,0.030524524,0.12187002,0.29379368,-0.098413505,0.2760112,0.13435225,0.6553861,-0.20698012,0.4885117,-0.07788008,1,0.4735691,0.10781375,0.26273063,0.065750375,-0.5767835,0.3132554,0.105511725,0.57649666,0.60816324,0.33739704,-0.32449156,-0.041451417,-0.7797632,0.12576614,0.013008317,0.5172053,-0.5321433,-0.4858393,-0.5352969,-0.9561075,0.36434704,-0.5873056,0.073353216,-0.74967647,-0.35217264,0.5914082,0.05775382,0.46581274,0.75113964,0.20258841,0.6135037,0.027755521,0.4579089,-0.14112566,-0.8323887,0.6679382,-0.21494907,0.15424307,0.06666604,-0.14928402,0.9999999,-0.84093535,-0.5683802,-0.5388129,0.99759144,0.39646333,-0.07260067,-0.9999677,-0.22463875,-0.6892473,-0.16948251,-0.4257808,-0.047285024,0.049222283,-0.6389739,0.48376748,-0.33937532,0.6290037,-0.4899918,0.016156008,0.5636063,-0.012865309,-0.9996453,-1,-0.99224967,0.5579836,0.44698465,-0.6731072,-0.07331315,0.7597576,0.042515397,0.8845972,0.84938824,0.50474465,-0.11087728,-0.16929562,0.43734756,-0.25591615,0.6451199,0.07316427,0.15167686,-0.95505095,-0.9990458,-0.088007644,0.59289175,0.4991592,0.18567607,-0.54600185,-0.92206067,0.58595294,0.54168,-0.052323904,0.23038433,-0.7779268,-0.15971729,-0.8255273,0.050288297,-0.24421081,0.16384944,0.12270725,0.661596,0.08668808,-0.26661158,-0.14475258,-0.3397997,0.67826074,-0.9894874,-0.17134683,0.057450596,0.06149792,0.1079426,-0.055716194,0.18962933,-0.078298785,-0.026303194,0.32229885,0.51308155,-0.24559793,0.5104253,0.07646663,0.7055762,-0.25569496,-0.367556,0.9995982,0.6778547,-0.38884512,-0.5492965,0.47232416,0.003356639,-0.02377825,-0.8243619,-0.07637227,0.44021648,-0.40326586,-0.2815097,-0.20456985],
    [108,0,"COc1ccc(-c2ccccc2)cc1NNC(=O)OC(C)C",0.26712975,-0.2778525,-0.3988874,0.36502305,-0.34472185,-0.36706796,0.16204788,0.7901776,-0.10282408,0.36522493,-0.54531693,-0.11964625,0.28486404,0.11304798,-0.036426663,-0.30670428,-0.29444247,-0.109770134,-0.1481996,0.3282046,0.22612734,-0.4034492,0.7301294,0.56029975,0.7596602,0.078143865,0.3309098,0.20853205,0.282656,0.07118511,0.14604972,-0.2226266,-0.5725106,-0.3783545,-0.6470224,-0.13042447,0.7047444,0.09556977,0.9967973,-0.79198754,-0.88707864,0.15838107,-0.13132149,-0.0344782,0.055770643,-0.75986266,-0.18188773,-0.15962759,0.78506196,0.42694658,0.010411183,-0.117586344,-0.12384608,0.11797947,-0.3076965,0.58524925,-0.39499277,0.038365785,0.29926753,-0.05415294,-0.6028457,0.5676071,0.29179674,-0.6582571,-0.21821691,0.41611904,-0.034280945,-0.026053475,-0.19326001,0.6540196,-0.8170553,-0.9387643,0.11200376,-0.5497905,0.61177516,-0.5171055,0.009063335,-0.1877229,0.30680883,-0.998896,-0.47594464,-0.25459033,-0.9212358,0.11639766,0.087600924,-0.8458923,-0.45361057,0.33517003,-0.6169715,0.40386012,0.10070219,-0.54201996,-0.13950653,0.7762397,0.9984738,-0.3233528,0.29562077,0.14967188,0.19106781,-0.3705752,0.38587457,0.05461503,-0.32643107,0.86221194,-0.96954685,-0.6291505,0.40042502,0.37665018,-0.9994416,0.10478891,-0.11660591,-0.42755616,0.091187045,-0.08337881,0.18177326,0.38379163,-0.05621384,0.17855403,0.99397516,0.09678854,0.57676387,0.001309747,0.44735527,-0.04750994,-0.32563296,0.27536732,0.23813626,-0.066647656,-0.30881166,0.9997261,-0.23662978,0.05557954,-0.40160713,-0.10655903,-0.68480915,-0.98293483,0.06942285,0.66270214,-0.55136657,0.21893692,-0.99975085,-0.23548403,0.87363803,0.24789834,0.4504381,-0.31919375,0.10048499,0.33848977,-0.6219364,-0.14702834,0.58812517,0.758593,0.31018534,0.32291085,0.03138476,-0.28183448,-0.61251473,0.6500611,-0.73285604,0.89695466,-0.856235,0.020772662,0.09554736,0.6818218,0.1520335,-0.24529204,0.32074407,0.34370977,0.15305242,-0.021726778,0.29245526,-0.5786133,0.30740246,0.25123373,0.21372797,-0.86560696,-0.4233599,0.1573361,-0.5449109,0.08716321,0.41490233,-0.8467051,-0.12882288,0.15678972,-0.11192473,-0.827326,0.64765096,-0.494742,0.0822574,-0.33182505,-0.055549636,0.41089642,0.40680823,0.48889488,-0.28167954,0.17266196,0.11301394,-0.8253708,0.34910774,-0.15349676,0.34053525,-0.6117257,-0.35354656,0.4303646,0.29753494,0.25124708,-0.07949603,-0.33238158,0.46424362,-0.99986786,-0.5440349,0.4011441,0.13689727,0.03708676,0.20669034,0.1316113,-0.45318782,-0.038930047,-0.35771433,0.7236728,0.21667868,0.1538489,-0.7876596,-0.70137805,-0.9288799,-0.15602122,-0.08827801,-0.41025245,-0.22432491,0.69039774,-0.63279897,0.08221526,0.48946935,-0.73668045,-0.43188536,-0.68248445,-0.81229013,-0.05755332,-0.4051664,-0.13436288,0.89819026,0.08316652,0.038051605,-0.09707496,0.15822746,-0.2981856,0.21743196,0.34416237,-0.39822903,0.02568922,-0.46094888,-0.9780039,-0.50396043,0.63736004,0.06613054,-0.027273733,0.53520703,0.46127918,0.33628392,-0.698737,-0.6774503,0.589923,0.113303885,-0.5145834,-0.15812033,-0.07045539,0.51716685,-0.2485359,-0.6324734,-0.027652072,0.18590115,0.98301476,-0.19658813,0.34541443,0.77721745,-0.7891573,0.40843767,0.9196114,-0.33754122,0.16564727,0.69208896,0.99767494,0.35140198,-0.26785922,0.120677724,-0.22837952,-0.69269454,-0.2964367,-0.9765365,0.076045826,0.40705985,0.96770906,0.306621,0.58785605,0.41719446,0.3828412,0.9999105,-0.9864479,0.47297296,-0.32577258,-0.60296303,-0.07575597,-0.2744709,-0.2659151,0.02359167,-0.1457654,-0.7086627,0.15064842,0.485922,0.27025154,0.13875292,-0.23886947,0.000917101,0.48211324,0.42883644,0.030171677,0.21396594,0.18473409,0.9282027,0.5807403,0.1518665,0.48034573,0.013369462,-0.5570337,-0.10854672,-0.06572807,0.18685897,-0.9562151,0.008886589,0.005878525,-0.07915037,0.40436116,0.41936627,-0.4531068,0.015315047,0.40370566,-0.22630554,-0.41574252,-0.3324074,0.6938555,0.16878153,0.16193202,-0.8056614,0.07458312,0.7378587,0.48256493,0.071643986,0.38784048,0.04318212,-0.6578996,-0.96415895,0.6076166,-0.8404952,-0.12787215,0.08491578,0.016044447,0.22587895,0.99978817,0.21643607,-0.25173786,0.087815344,-0.7628381,0.55534464,-0.0940863,-0.8316406,-0.39782834,-0.13612212,-0.5224477,-0.6104495,0.06282671,0.0531853,-0.24448639,0.17590743,0.08697531,0.020531153,0.9971417,0.005295011,-0.3926064,-0.05790557,-0.54331696,-0.30775285,-0.20561217,0.38559365,-0.037628554,-0.23494583,0.053923313,0.5041586,0.23826443,-0.090860166,0.56349623,-0.14117274,0.10111524,-0.22593778,0.19401042,-0.09463871,-0.5771038,-0.2346711,-0.22703958,-0.45784113,-0.24296878,0.19918387,0.36394468,0.64491886,0.3802451,0.05872562,-0.5391255,0.2749858,-0.6941667,-0.13310397,0.0061054,-0.29216716,-0.34201303,0.3387038,-0.08926463,0.29689708,0.117472865,0.96221113,-0.12135489,-0.95915955,0.38116014,0.99922115,-0.14048968,0.37996763,-0.97630346,0.0323467,-0.8122327,-0.17540321,0.49055636,-0.2438485,0.13993323,-0.3360766,-0.31693444,0.19722186,-0.012835327,0.37367928,-0.3034475,0.6818531,-0.60116863,-0.99992466,0.9945545,-0.76511586,-0.59818655,-0.11531146,-0.6158844,-0.17286767,-0.15944877,-0.40605733,-0.19192618,0.11846915,0.117175244,-0.72661203,-0.46732113,-0.011569323,-0.6357345,0.45088515,-0.5831752,-0.23966901,0.10589693,-0.9998348,0.08547631,-0.32020152,0.2153513,-0.2802523,-0.67623407,-0.9234926,0.2900917,0.270811,-0.5377612,-0.5267624,-0.45174393,-0.77308947,0.96113646,-0.51779824,0.56609136,0.052318003,0.46306524,0.6694448,-0.7794944,0.74665624,-0.17505644,-0.09631359,0.17175013,-0.53780276,-0.44925815,0.39085838,0.5658353,-0.3942549,-0.3977259,-0.4777237,0.71940583,-0.05967591,0.42490116,0.60937184,0.9850499,-0.30378953,-0.55294055,-0.10437085,0.22618409,-0.082693025,0.9998628,0.7595518,-0.5162275,0.16907436,-0.2775197,-0.5526093,-0.6131643,-0.9932716,0.412414,0.5941201,-0.5874206,-0.18428814,-0.2552356],
    [109,1,"CCN(CC)C(=O)C(C)Oc1cccc2ccccc12",-0.7540715,0.279404,0.18314181,0.35323277,0.23227838,-0.6701385,-0.47482255,0.06868706,-0.1798708,-0.19566078,-0.48047656,0.30502972,-0.12159717,-0.45799336,-0.046015147,0.078356124,-0.38495705,-0.64531994,0.12653688,-0.6249673,-0.32484007,-0.7077486,-0.4870447,-0.6141398,-0.5928592,0.5393295,-0.3341353,-0.056064226,-0.4504848,0.6169012,0.36944738,-0.23647256,-0.014277572,-0.8850229,0.10389397,-0.40624717,0.08838823,0.81671685,0.99208164,-0.72154397,-0.99869704,-0.39990428,-0.33465433,0.31256768,0.3117444,-0.90249664,0.31901217,0.6519818,0.90347415,-0.3886665,0.56580734,-0.33177608,-0.20682321,0.445817,-0.7516081,0.21276186,-0.3570048,0.3767557,-0.27335015,0.110552624,-0.35990408,0.12308751,-0.30592737,-0.2514865,-0.33054352,0.16705807,0.22876859,0.72034264,-0.47036907,-0.45600608,-0.46189886,-0.953666,0.47801968,-0.082491115,0.5304053,0.29911783,-0.2950386,0.045023985,0.101843506,-0.9998023,0.42698324,0.1997055,-0.86391073,-0.2831552,-0.04097279,-0.8123916,-0.5495926,-0.21857214,0.15505217,0.43154195,0.2081269,0.3417533,-0.053983595,0.21896495,0.9726016,-0.2491543,0.5006389,-0.43553093,0.54299504,-0.22847307,0.68735296,0.13673183,0.39568323,0.82100075,-0.82792133,0.006198017,0.30780962,0.554672,0.9774281,-0.5757436,0.68099153,0.5279799,-0.29768324,-0.43434897,-0.08778877,0.6939149,0.35866016,0.5737955,0.9953669,-0.034461003,-0.27181983,-0.55733114,0.41949058,0.07380494,-0.049986348,0.48352313,-0.3516552,0.42800888,0.13215253,0.99983037,0.20549917,0.16015399,-0.14923847,-0.42080694,-0.24717411,-0.98782516,-0.065059505,-0.11681442,-0.6671635,-0.49012905,-0.99963397,0.3088605,0.96229064,-0.5485239,-0.5998332,0.36230555,0.15537058,0.30766934,0.35432556,-0.29178062,0.19714403,-0.14481829,-0.20399192,0.40423357,-0.003984202,0.18969578,0.01768717,0.90478414,-0.38776436,-0.9567689,-0.9208607,-0.10851957,-0.8851989,0.56365573,0.23800567,-0.40065137,0.07578307,0.042948704,-0.54720825,0.54582876,0.23897459,-0.22202119,-0.1638525,0.5617372,-0.46683037,-0.9559441,-0.5795787,0.79767007,-0.115472935,-0.23448119,0.5761613,-0.42738312,0.50988245,-0.19374657,-0.49259502,-0.5721986,-0.12738048,-0.5021692,0.12378774,-0.20163782,-0.7531671,-0.17899656,-0.14827926,0.002767201,0.47156715,-0.485922,-0.65304697,-0.9290754,0.64031506,0.51070684,-0.01190067,0.4747206,0.6015575,-0.15243538,0.6049685,-0.26088023,-0.39329153,-0.17043321,-0.08792007,-0.9997343,0.5252535,0.003045813,-0.055918515,0.28430298,0.39454365,0.12617321,-0.18438554,0.17607065,0.46358576,0.15450864,0.45662653,0.6148251,-0.6397931,0.14406626,-0.9886153,0.29005775,0.38697392,-0.04461825,0.08930586,-0.30772817,0.07525021,0.45474553,-0.23950228,0.1697354,0.027395029,-0.255749,0.096334115,-0.53532183,-0.42034796,-0.37773755,0.8915382,0.38089272,0.4046162,-0.14306521,0.53004384,0.050413214,-0.040516414,-0.37816465,0.074228056,-0.16738929,0.53279585,-0.97138464,-0.13578646,0.10662441,0.14103389,0.04498669,-0.6186487,0.066499196,-0.30046654,0.5808892,-0.27006134,-0.49747136,-0.68998146,-0.38496238,0.45105034,0.52329284,-0.005610263,-0.3214966,0.8598226,0.38569093,0.12630156,0.59503806,0.3237378,0.3928873,-0.13122945,-0.7538039,0.59123236,-0.5740546,-0.6025819,0.041525133,0.05359397,0.9991523,-0.5767937,-0.23177998,-0.6985162,-0.07508968,0.36758485,0.8919189,0.94595176,0.09015076,0.15035786,0.9908905,0.40461314,0.54714406,0.009511612,-0.6831735,0.9999171,-0.97857475,0.012173683,0.0867845,-0.10539248,0.09259035,-0.38937438,-0.32195044,-0.47448832,-0.5735835,-0.31370035,0.0918474,0.64740443,-0.37111816,-0.82820976,-0.16523635,-0.12824574,-0.38029468,0.64261997,-0.16510192,-0.41917083,0.06234526,-0.99998105,0.47794923,0.2626445,0.5064905,-0.23175283,-0.2797576,-0.0446675,0.56485695,0.16078024,-0.9584642,-0.68661636,0.70359707,-0.30808023,-0.38610435,0.030821947,0.019823987,-0.54243404,0.3189188,0.008780307,-0.58701116,0.18407829,-0.027955687,0.29762125,0.6627224,0.56558466,0.861928,-0.002540546,0.02762276,0.21547613,0.69949144,-0.37419912,-0.31147113,-0.9892934,0.7597002,0.7619266,0.7359871,0.61086875,-0.27550694,-0.06800759,0.9998652,-0.25937814,-0.6064484,-0.4392245,0.016281394,-0.39636534,-0.17974028,-0.88302547,-0.088176504,-0.44870177,-0.4579226,-0.37157807,-0.1857009,0.28756925,-0.4633015,-0.23859864,0.66755664,-0.19569124,0.9994505,0.44038105,-0.28604263,0.4117642,0.033412665,-0.12212162,-0.4445323,-0.00784163,0.5356696,0.3599648,-0.3587531,-0.12792109,0.48930603,0.61849296,0.344287,0.2585479,0.18984373,0.38134745,-0.18621053,0.26765928,-0.73925966,-0.2657606,-0.6888096,-0.05351435,-0.28354716,-0.5113556,0.13501757,0.101011895,0.5208968,0.50494003,-0.4995937,-0.4069631,-0.8056681,-0.805632,-0.03495772,-0.4390592,0.30108097,0.3338338,-0.066336155,0.009568562,0.40224427,0.99999994,0.080882035,-0.9223265,0.26923317,0.9998971,0.018497638,-0.4435366,-0.9999696,-0.008664461,-0.5723572,0.17636892,-0.2562683,0.5028194,0.13166629,-0.021555776,0.103162184,-0.11326598,-0.44628853,0.15026091,-0.23879552,0.21182805,0.066233344,-0.99995184,0.9868403,-0.78859967,0.8367772,0.50186807,-0.19825402,-0.43774512,-0.28688708,-0.66162455,0.16727395,-0.006257027,-0.048081513,-0.6697764,-0.40268025,0.004994987,0.08089609,0.07223952,0.38562998,-0.015752308,-0.33413073,-0.99987805,-0.18887186,0.68020517,0.16062479,0.15759438,-0.047317777,-0.9849003,0.057223607,0.30600393,0.26553106,0.12854412,0.3204386,0.70600367,0.9818838,0.46350956,0.8424339,0.4594491,-0.22580026,-0.18126419,-0.26932323,-0.6874094,0.66862136,0.2584853,-0.69444305,0.8266424,-0.44426563,-0.25422242,-0.3633921,0.2658504,-0.38264918,0.24420951,0.6204699,0.15166172,0.37420186,-0.6897791,0.96412694,-0.17406023,0.086144835,-0.18124746,-0.6421581,-0.007173944,0.99994177,0.27804288,0.26829976,-0.038843583,-0.40375158,-0.38425428,-0.3832091,-0.9386679,-0.19021831,0.4096548,0.3976617,0.5966847,-0.26972267],
    [110,1,"CC1=C(C(=O)Nc2ccccc2)SCCO1",-0.5828802,-0.05685066,0.15263627,0.1314875,0.054889854,-0.12558222,-0.2362301,-0.63307613,-0.05725519,0.44858092,-0.468746,-0.2219452,-0.25953355,-0.31452563,-0.12642302,0.18292671,-0.3654619,-0.21323048,0.09649246,0.18511425,0.7286938,-0.6297711,-0.2351767,-0.10625183,0.13500816,-0.007988382,0.19732052,-0.415875,0.24411827,-0.13506293,-0.16435145,0.2095655,-0.410029,-0.08046896,0.43327096,0.13781118,-0.31190774,0.55704844,0.9308419,-0.8498991,-0.9955317,-0.3364789,0.6009499,0.04499865,0.26146767,-0.9782701,-0.008574863,-0.16214114,0.96024185,-0.018856363,-0.4433513,0.19153993,0.3067765,0.40245217,-0.3353498,0.14187053,0.058787584,0.7779546,0.41254807,0.03776493,0.05762791,-0.72589505,-0.25588742,0.19694376,0.010166269,-0.20586294,0.115560316,0.59172326,0.34698123,0.5699447,0.084317654,-0.9883569,0.013796183,0.07865677,0.43670237,-0.4152246,-0.088055745,-0.6706286,0.101431526,-0.99971426,0.3481543,-0.032748654,-0.87421477,0.16536969,-0.04262123,-0.28789982,-0.21414168,0.41012836,0.013257759,0.05659099,-0.33288747,-0.04344623,0.123158686,0.05855274,0.9894279,-0.42919314,0.12541686,0.47063518,0.60215193,-0.3396497,0.07135202,0.005917353,-0.15301569,0.92344457,-0.2643973,-0.78993106,0.32591137,0.26392478,-0.8384244,0.013815692,0.005463318,0.347826,-0.62509024,-0.042379927,-0.4629,0.48852092,0.034446474,-0.1840726,0.99846786,-0.16216671,-0.47340986,-0.30794927,-0.23712401,-0.10655653,-0.35072005,-0.16369635,-0.48880142,-0.22819139,-0.5137852,0.99679375,-0.144956,-0.002378504,-0.37821037,0.61301696,0.3567901,-0.9898039,0.33892208,0.552007,-0.3204562,0.6968859,-0.9999963,0.38187057,0.9355602,-0.6543244,-0.24377014,0.10620933,-0.26725233,0.60176903,0.8541332,-0.6938204,-0.02669106,0.6686608,0.012565018,-0.2698594,-0.12249836,-0.17826079,0.29072076,0.9900339,-0.5922331,0.02543415,-0.97459906,-0.5633054,-0.6620119,0.49620533,0.3457885,0.055218276,0.44885418,-0.035703667,0.13564104,0.79889643,0.008831517,-0.13290575,0.22505873,0.023533022,-0.2323456,-0.915067,0.000568106,-0.39426577,-0.20563203,-0.7219053,-0.6062897,-0.43093503,0.05814903,0.27846506,-0.84268725,-0.41040352,0.04860599,0.01099993,0.07089505,0.08203159,-0.41507164,-0.40872374,-0.11174825,-0.18138775,-0.06607254,-0.4343191,-0.6421459,-0.8575576,-0.30924776,0.23607783,0.25683865,-0.23758078,-0.16460523,-0.37630516,0.0482145,0.31504256,0.09463871,0.13240932,0.046342663,-0.9987936,-0.39174864,0.1790887,0.26897904,-0.12210992,0.27362585,-0.12985075,-0.46022663,-0.17506556,-0.25892296,0.09525945,0.58468306,0.24417818,-0.69422555,-0.2409977,-0.93478113,-0.010445232,0.7400755,-0.15214454,-0.28855544,0.70178515,-0.34284416,0.346568,0.66975135,-0.4992191,0.072658196,0.28885955,0.4147671,0.08601791,-0.2744572,0.2599876,0.8834994,-0.05021473,0.034240846,-0.0446691,0.08308917,-0.11959241,0.39044848,-0.7398281,0.7433534,-0.4976842,0.17053953,-0.9746298,0.09149594,-0.041991808,0.47096628,0.20239858,0.14582345,0.42179996,0.09635581,0.20241757,0.20441419,0.6428493,0.63529944,-0.007584434,0.17916852,0.29616153,0.006452379,0.09060506,0.8012637,-0.15066923,-0.21775346,0.736443,-0.73789084,-0.677846,-0.6536216,0.5407886,0.18523936,0.3192177,0.39243677,0.25101054,-0.3635056,0.999476,-0.692537,0.28187197,0.47537568,0.023694644,0.5026729,-0.44852176,-0.81706566,-0.32165843,0.43359452,0.9984394,0.48256758,-0.011586623,0.1243503,0.082093,0.9999984,-0.942635,0.023883926,0.002563102,-0.5169951,0.32024077,0.63898885,0.08919322,-0.515909,-0.14861044,0.8532598,0.52586484,0.56854486,-0.74125946,0.1739946,-0.5409651,0.13055816,-0.37260312,0.79856473,-0.60325396,-0.34076047,-0.1688097,-0.9797677,-0.5803864,0.10476604,0.18190442,-0.6460641,-0.3674574,-0.032235388,-0.03219766,-0.324253,-0.6844245,-0.4604635,-0.70032173,0.15501769,0.48220536,0.08260984,0.13244538,0.67469186,-0.22921927,0.1648763,0.67595,-0.5165079,-0.26044202,-0.19748817,0.38917756,-0.1906214,0.7674981,0.35318467,0.1078996,0.6202297,-0.06870519,-0.22964118,0.54067576,-0.9944343,0.7297271,0.008170939,0.4008618,-0.3824706,0.26608753,0.20685661,0.99981874,-0.30145818,-0.35688972,-0.48768583,-0.030429473,-0.5736972,-0.49974796,-0.16945885,0.71002704,-0.3237679,0.09130539,-0.36961824,-0.24822867,-0.6427419,0.14708476,0.3750152,0.5415314,0.3212246,0.99759495,0.056870166,0.5458879,-0.099285915,-0.36409247,-0.75161755,-0.5234538,-0.5291777,0.296767,-0.43369856,0.41253024,0.53749335,0.63364536,0.4392391,0.30588356,0.35649118,-0.23204893,-0.115997195,-0.40952277,0.22160865,-0.08922901,0.13426048,0.11478559,-0.019307269,0.06642459,-0.22518463,-0.1150236,0.21749869,0.26956788,-0.034362983,0.37331012,-0.037032027,-0.53493774,0.29789612,-0.6572156,-0.15091252,0.23124945,-0.18278246,-0.4602525,-0.07672408,0.08942109,0.99997365,0.05386646,-0.97991294,-0.28611368,0.9996404,-0.4102241,0.2924981,-0.99950486,-0.19029313,-0.43543956,0.24977551,0.30950987,0.077432886,0.061037567,0.14503074,0.5761306,0.57615656,-0.32288507,-0.16256605,0.3983192,0.62812966,-0.55470914,-0.9999777,0.9941315,-0.9435727,-0.115216136,0.61006486,0.31307146,-0.3159588,0.43072823,-0.7708906,0.5408575,-0.17083997,0.22672674,-0.81029946,0.15223894,-0.10668556,-0.29428053,0.63343614,0.050645605,-0.2951487,-0.9153268,-0.9999153,-0.1389054,0.18314797,0.25420535,-0.18014577,0.27109483,-0.9475683,0.1733239,-0.3080865,0.25277382,-0.47697878,0.17203051,0.46607572,0.7837439,0.07447975,0.8376041,-0.124560505,0.07719066,0.550911,-0.6361959,-0.47267827,-0.24512528,-0.03780343,0.028766455,-0.45358047,0.11665452,-0.45099744,0.35081756,-0.57023984,-0.09668271,-0.007605738,-0.71151775,0.37090677,-0.60192025,0.52211875,0.38825095,0.15688603,0.38619772,-0.1703542,-0.3929182,-0.20652285,0.9999146,-0.25154328,0.011185217,0.51604795,-0.2689595,0.5646157,0.4870095,-0.8868048,-0.045995325,0.1989016,-0.20682953,-0.2700043,0.21267968],
    [111,1,"CCOP(=S)(OCC)SCSCC",0.96127594,0.14201503,-0.3285781,-0.02341975,0.6472665,0.56693256,-0.887603,0.057765625,-0.74840367,0.61393774,-0.72364825,0.61065704,-0.59894717,-0.4472558,0.065213256,-0.4166675,-0.687157,-0.05439298,0.39061195,-0.13672885,0.07806176,0.050232366,-0.43826696,-0.04870541,-0.26961735,-0.2089479,-0.45011708,0.32366937,0.13336997,-0.36850807,0.28251377,-0.5373867,0.11008326,-0.7032927,0.1458857,-0.34915188,0.18886095,-0.3335217,0.67733324,-0.9106058,-0.9844345,-0.28322282,0.18282261,0.41125205,-0.68000513,-0.98297364,-0.13010047,0.2438655,0.9936911,0.38499382,0.57231754,-0.5131306,0.26628232,0.114846654,-0.7958364,0.1305523,0.18168624,0.877683,0.32759735,-0.46576184,0.21968009,0.6161996,0.19492592,-0.021182781,-0.3760084,0.76608795,-0.5088126,0.011892319,0.27987462,0.38501805,0.52110445,-0.94932616,-0.52357095,0.84053594,0.18774757,-0.86276394,0.7216646,-0.40782607,-0.12445195,-0.9996565,0.7615204,-0.07989876,-0.033694897,0.13371909,0.66680396,0.028351057,-0.09204462,0.4086362,0.3939392,0.09632675,0.4803456,-0.26854813,-0.29567903,-0.22137988,0.98683673,0.70810765,0.41632125,0.47756386,-0.036955584,0.5208673,-0.392253,-0.09617132,-0.47168922,-0.64233595,0.6793584,-0.92564625,-0.3961844,0.4762439,0.9926912,0.38330588,0.18734892,-0.2628746,-0.63530236,-0.32747126,0.06281841,0.1548725,-0.19059467,0.20344955,0.9990332,-0.021225672,-0.6850841,0.3613982,0.5339387,0.6235037,-0.4797558,0.26576746,0.12724689,-0.6513064,-0.6276322,0.9979451,0.54614985,0.42661348,-0.023021085,-0.7475203,0.535507,-0.9812008,-0.5982898,-0.3263317,-0.03413352,0.17009038,0.99927163,-0.41294506,0.97038966,-0.7955261,0.3416539,-0.01862307,-0.3667377,-0.254909,0.93496794,0.53730816,0.45202917,-0.9220263,-0.13562654,-0.3842264,-0.1579122,-0.5431146,-0.45680118,0.99767643,-0.83376384,-0.94195974,-0.9668705,-0.7418954,-0.12677242,0.19748211,-0.79480475,-0.19709453,-0.47562534,0.5885876,0.36628142,0.48313257,0.18972103,0.39701736,0.5360294,0.38743088,-0.5630985,-0.79339486,-0.711151,0.24290968,-0.79477775,0.38843876,0.38500807,-0.7840207,0.6695623,0.7575536,-0.62428963,0.2271897,0.900422,0.5611753,-0.63153815,0.5691547,-0.063982084,0.07639261,0.5544655,0.7021403,-0.49866188,0.11673263,-0.50929636,-0.88481975,0.29245105,0.29384473,-0.38977197,-0.31227347,0.27853572,-0.80792713,-0.7234707,0.20939532,-0.3907445,-0.8569834,-0.06240668,-0.9950853,-0.41067734,0.6316763,-0.69690275,0.6268419,0.532488,-0.16685885,-0.8140216,0.20563461,-0.6117521,0.6888088,-0.33008912,-0.6862774,0.021403164,0.47032887,-0.98060447,0.15719953,0.31775194,-0.31969234,0.083338365,0.6970316,-0.56379324,-0.048534203,-0.5285682,-0.09793755,0.12143275,0.09082453,0.24462165,0.04007628,0.22088684,-0.024900414,0.9067113,-0.6080399,0.22312108,0.7591403,-0.20692658,-0.41682768,0.60830635,-0.5499689,-0.84144664,0.10671268,0.33060297,-0.9997848,-0.29597738,-0.15781799,-0.23910715,-0.4223308,-0.47662875,0.30052885,-0.5400071,-0.028405204,-0.24878109,-0.2372827,0.77440214,0.5044011,-0.8222913,0.13600434,-0.60936016,0.41735283,0.10875501,-0.29589763,0.58656687,0.9950454,-0.5795548,0.6159191,0.8714765,-0.91933537,0.45990124,-0.2082259,0.24542435,0.84106576,-0.16750303,0.99665576,-0.7093894,-0.14225444,-0.76170856,-0.25625163,0.017300937,0.6360835,0.89750135,-0.725254,0.6854005,0.9991233,0.43340895,0.92678744,0.79701656,0.3094507,-0.9984771,-0.83811885,0.45372662,0.44806194,-0.3493944,0.5421599,0.10426654,0.451344,-0.4739535,0.30708683,0.9897911,0.6920369,-0.26578248,0.4601707,0.7703056,0.2235048,-0.5531705,-0.21103208,0.40653235,0.72447795,-0.060092576,0.287497,-0.9999584,0.21456839,-0.059137896,-0.75555223,-0.11089607,-0.89436734,0.7775656,-0.79594225,-0.09702401,-0.58473414,-0.097337484,0.31845057,0.2126724,0.26928362,0.57219625,0.11386491,0.005529809,-0.033072457,0.16572861,-0.5243,0.21285574,-0.571608,-0.18099862,-0.26956972,-0.4481606,0.5943804,0.3727437,-0.48528853,-0.49039987,0.85471785,-0.098430336,0.815802,-0.9804058,-0.8278517,0.4971133,0.52154815,0.49995747,0.24993731,-0.13325031,0.9996414,-0.67493886,0.06984224,0.3878008,-0.6557377,0.45905602,-0.61638075,0.14101404,0.03115409,0.08592963,0.39966264,-0.16313955,0.30955955,-0.046249356,0.6454493,-0.21292365,0.49247715,0.26070985,1,0.41018575,0.09120229,0.27789122,0.071604885,-0.76975137,0.3335757,0.0723031,0.58964777,0.48792782,0.032114513,-0.47437406,-0.2289796,-0.81164104,0.27119857,0.1417926,0.5329101,-0.7177164,-0.4408978,-0.40699393,-0.946714,0.28430805,-0.5057861,0.4176386,-0.6766093,-0.42135623,0.42138404,0.1454649,0.30263847,0.7030717,0.13490944,0.4725783,0.20006116,0.61387515,-0.105048575,-0.8510363,0.76478684,0.10498115,0.040466517,0.28363034,-0.17623833,1,-0.8670005,-0.6616965,-0.54403293,0.9971212,0.32439724,-0.12098631,-0.99996185,0.043881178,-0.669985,0.08290637,-0.2243121,0.18843438,0.07110529,-0.4911988,0.61754024,-0.2791928,0.4874454,-0.3796495,0.053322442,0.57183576,-0.11002503,-0.99970335,-1,-0.99572635,0.43050048,0.5328696,-0.68417263,0.017412975,0.6874024,-0.3517104,0.80620736,0.8696587,0.3720837,-0.010390972,-0.18584126,0.37537935,-0.5511371,0.39194322,0.2548501,0.38899046,-0.97669965,-0.999163,-0.07481327,0.6640797,0.5171592,0.39196652,-0.46127325,-0.9280824,0.6930926,0.5802389,-0.11792668,0.2554401,-0.7986397,-0.33510914,-0.8645022,-0.007356983,-0.3379883,-0.055655483,0.20308727,0.58454674,-0.07730587,-0.015774421,-0.05788605,-0.4864377,0.7260867,-0.9965097,-0.17430884,-0.12225268,0.11387912,0.11361127,0.14374928,0.33451745,0.109082446,-0.013945656,0.2988437,0.4918594,-0.5531723,0.5087843,0.20946704,0.59601736,-0.4986917,-0.23221445,0.99942,0.70388687,-0.3002742,-0.21447508,0.28808177,0.14028072,-0.11128259,-0.63242114,-0.2639118,0.59060735,-0.4464784,-0.38776982,-0.07851801],
    [112,1,"CC(C)(C)c1csc(-c2cc3cc(OCc4ccccc4CC(=O)O)ccc3o2)n1",-0.49616754,0.46119744,-0.13576359,-0.31859615,0.2884134,-0.13521288,0.20074306,-0.15242273,0.7639591,-0.70554,-0.52274954,0.6308469,0.2781873,-0.099350154,0.5003792,-0.07214127,-0.006128688,0.0983534,0.45211998,-0.01678997,0.33606732,0.41664997,-0.24706347,0.30397123,0.34502727,0.30195788,-0.54174733,0.5207622,0.5095698,0.6469467,-0.5276034,0.24200362,0.7350107,-0.43575776,0.2739247,0.19198631,-0.32701072,0.5418451,0.9996471,-0.61676776,-0.192235,0.4044714,-0.061422832,0.47708187,0.037753217,0.8249786,-0.53212696,0.29828435,0.58275306,-0.13085695,0.64659315,0.8087808,-0.41806266,0.27123576,0.15983424,-0.5646834,-0.116358645,-0.8743083,0.4133328,-0.22299527,-0.023755608,-0.24502718,0.62338275,0.47069436,-0.5282495,0.15127473,0.62270075,0.39373484,0.38164717,0.40689403,-0.9299233,0.48055506,-0.5052087,-0.90807426,0.23091623,0.13537161,0.08584637,-0.6825587,-0.1533144,-0.99930006,0.2685194,-0.086545266,-0.9084376,-0.0744997,-0.2075073,-0.98940307,-0.5807344,-0.23416321,0.61499393,0.6520045,0.36433348,-0.600713,-0.19882378,0.15396549,0.99099517,-0.49005237,0.8446435,0.2550115,-0.21258844,0.5166649,0.54603124,0.64636576,-0.206117,0.976372,-0.9996647,-0.90327406,0.67705464,-0.1359152,-0.9446503,-0.10272635,0.31515494,-0.49641404,0.5940838,-0.003434949,0.31887388,0.41131118,0.13499655,0.2658101,0.5497984,0.44607565,-0.075256325,0.56419027,-0.21352607,0.15314507,-0.574026,-0.05742185,0.06016646,-0.25029507,-0.047490668,0.9999366,-0.037275594,0.52598155,0.54470813,-0.41157824,0.002175929,-0.96418005,-0.69470376,0.17740837,0.53957146,-0.58737385,-0.99999774,0.7118813,0.3395762,-0.3681565,-0.33953443,0.9088628,-0.6619802,-0.001035017,-0.9978729,0.040938478,0.02302343,-0.30837202,-0.31128117,0.5349845,-0.6706275,-0.27281386,-0.51256025,-0.98117715,-0.6999702,-0.8362017,0.45148152,0.37124765,0.32726574,0.21964265,-0.5882124,-0.29936284,0.18127222,0.40261158,-0.21104395,0.43825534,-0.6607268,-0.47530812,-0.34471628,-0.42582905,0.74167156,-0.7721205,-0.66052765,-0.2090762,-0.4855762,0.21499257,0.4468758,-0.8219557,-0.14746088,0.7459946,0.51690304,-0.30242255,0.28999618,-0.47596732,0.79475933,0.7672664,-0.4160966,0.31674218,-0.26816422,0.34834257,0.40158904,-0.4260599,0.6017685,-0.544267,0.16881561,0.46910113,0.910763,0.15923743,0.8331706,-0.47405648,0.5978367,-0.38518882,0.7324139,-0.84117717,0.21174805,-0.999869,-0.2163076,-0.6679784,0.5332235,-0.02720605,0.6390554,0.33365706,-0.72616374,0.51713645,-0.7400655,-0.8206919,-0.28547978,-0.4600469,-0.22851096,-0.5381386,0.98512554,0.3277521,-0.6514275,-0.08149562,-0.041517276,-0.26360282,-0.41863087,0.10929403,-0.22508486,-0.31388798,0.5601539,0.2335812,0.18555258,0.2348996,-0.31561193,-0.70493454,0.932791,0.510068,0.2311552,-0.522311,0.5358733,-0.17132108,0.18198766,0.18339571,-0.44354892,0.6506179,0.064743385,-0.1593639,-0.7115705,0.77783364,-0.38518128,-0.04845459,-0.3755126,0.057076108,0.20372672,0.015038217,0.4046279,0.1138128,4.08e-05,-0.6557784,-0.07356202,-0.053342722,-0.20205769,0.22736119,0.94415325,-0.14197955,0.22474664,0.9967529,-0.28899145,0.67488956,-0.46295467,0.5135151,-0.2719178,-0.14809415,-0.23626754,-0.05249461,0.6775931,0.9140439,0.4613086,0.46225494,-0.19462156,-0.117161654,-0.3410474,0.76915526,0.4108277,0.124774635,0.8293584,-0.65763587,0.40699136,0.13826577,-0.6176835,0.7193346,0.999998,-0.9962592,-0.10411932,0.33593068,-0.009290957,0.40133876,-0.6588041,-0.3905471,0.7510614,-0.24014197,-0.99948275,0.18028215,0.7244283,0.29435,0.1167446,0.61701113,-0.5197741,-0.16276143,0.5491846,0.2997596,-0.46919352,-0.46966684,-0.96945816,-0.34225768,0.5429113,-0.21563704,-0.0625731,-0.8335149,0.39085427,0.12377613,0.45138493,-0.87300336,-0.11867124,-0.2980678,0.32552102,-0.2218769,0.8346078,0.3438265,0.85686547,0.937053,0.519899,-0.60450387,-0.01746289,0.452497,0.035430197,0.5686518,-0.22240715,-0.5093173,-0.78263754,0.83661413,0.8139511,-0.47913077,0.7965849,-0.97818905,-0.36049736,0.1684856,-0.5984893,0.15630472,0.6488339,-0.78870076,-0.7079351,0.99718714,0.003417829,-0.48250437,0.030857842,-0.56237245,0.002814788,0.4414077,-0.924532,0.23894091,-0.426431,-0.2693363,0.6100049,0.3270459,0.27979812,0.20477284,0.22876818,-0.84952223,-0.030839052,-0.9999999,-0.2218104,0.2371987,0.18157345,-0.5254848,0.3250118,-0.01903869,-0.17214672,0.23928022,-0.2309965,0.69291645,0.43907475,0.3133264,0.1621876,0.6597411,-0.40331328,-0.38256457,-0.6301524,0.5020337,0.6793281,0.3204286,0.1281005,-0.5249929,-0.5394876,-0.6052408,0.8582483,0.28604648,-0.16832429,0.10410926,0.25289056,0.39899543,-0.8503002,-0.21144152,0.382661,0.5185921,-0.22581954,-0.13051489,-0.36597037,0.089127325,0.17512874,-0.4639221,0.9998962,0.24910358,-0.97559553,-0.13785236,0.9979273,-0.6874859,0.7119488,-0.99943393,0.09975187,-0.90681076,-0.3032215,-0.4355599,0.72139126,0.16397578,0.60382587,-0.85100055,-0.6029643,0.3984868,-0.5003792,0.47633794,0.25987202,0.4491068,-0.9995236,1,0.90092397,-0.7332206,-0.8738218,-0.22421966,0.44548014,-0.24480943,0.1516098,-0.44734037,-0.2602978,-0.09628716,-0.6735723,-0.025101395,0.4904101,-0.70756143,0.13040866,-0.1909569,-0.13316168,0.98986644,-0.99535364,-0.2044951,0.012512269,0.4655084,-0.001832945,-0.21884087,-0.8582256,0.7473523,-0.34350824,-0.73054534,0.10975098,0.054771055,-0.33795863,0.9916852,-0.5838121,0.5401793,0.7233057,0.344727,-0.23488146,-0.48612463,0.19662908,0.058492377,0.2631849,-0.44862506,-0.8404596,-0.4665713,0.63873273,0.1656611,-0.14181934,0.38348225,-0.06351179,0.6203219,0.33316982,-0.1399176,0.16492717,0.99967706,0.63385385,0.5162823,-0.44821337,0.12084007,0.18929002,0.99993634,0.42629611,-0.49726793,0.57241577,-0.34139112,0.23918074,-0.46918014,-0.99915105,0.42055446,0.5771321,-0.48535544,0.099565685,-0.67054063],
    [113,1,"NCc1cccc(C2CCN(C(=O)c3ccc(C#Cc4ccccc4F)o3)CC2)c1",-0.8613198,0.011721089,0.43903252,-0.45539108,-0.29550108,-0.0351239,-0.29628932,-0.2996914,0.13696292,-0.3181311,-0.1872236,-0.09493428,0.26246914,-0.712102,-0.00161933,-0.3714534,-0.060026858,0.42389384,-0.39649442,-0.15258789,0.2796476,0.18557706,-0.30303505,0.1383799,-0.6193614,0.24184284,0.016940245,0.079421915,0.11100245,-0.66835064,0.3229093,-0.6483449,0.6232012,-0.5384217,-0.0966817,-0.17505054,-0.71221286,0.679598,0.99959546,-0.38412562,-0.11842771,-0.020330694,-0.38097665,-0.28008747,-0.034278072,0.46387607,-0.029457927,0.32053772,-0.6838867,-0.123901516,0.23837198,0.013945051,0.14865957,-0.05708533,0.3576152,-0.30370384,-0.10891455,-0.8702206,-0.13244645,-0.22614639,0.08902954,-0.55184776,-0.015401158,-0.14655446,0.20117456,-0.16517508,0.2458104,0.22106342,0.601987,-0.4053484,-0.989396,-0.7634437,0.006237537,-0.41923618,0.7999738,-0.31755257,-0.21063359,0.32063678,0.21438159,-0.9957126,-0.1844054,0.23934959,-0.8904125,-0.5701652,-0.5940027,-0.9763665,-0.16706845,-0.80158526,0.060413755,0.2213414,0.14326116,-0.12590565,0.43761066,0.09478194,0.9931851,-0.38099736,0.7227453,0.21696411,0.75946885,0.4188076,-0.36207938,0.69977224,-0.36160204,0.9958662,-0.9992389,-0.17512488,-0.35978597,-0.86905485,-0.95858145,-0.8536163,-0.74942183,0.31219992,-0.26405203,0.72064555,0.3938743,0.30190605,-0.22445773,0.19278769,0.7505957,0.4446986,-0.061331153,0.53345335,-0.085363954,0.21767572,0.3676968,-0.1619626,-0.53527784,-0.20913209,0.6201908,0.9999395,-0.228312,0.59001154,0.3814001,0.13014078,-0.2274768,-0.9699404,0.5377722,0.8312096,-0.49490634,-0.7346866,-0.9999997,0.3316777,0.53746283,-0.6034009,0.64558023,0.34430772,0.6087628,0.59377104,-0.9941483,-0.08686516,-0.56525564,0.504148,0.22440079,0.56607413,-0.21723653,0.07510938,-0.012299922,-0.9310686,0.08974089,-0.23037536,0.1917153,0.63423353,0.6438872,-0.46691152,0.18709859,-0.63999194,-0.19394994,-0.6236639,-0.58516383,0.6844134,-0.20876807,-0.01193055,0.21879204,-0.5225115,-0.14007388,-0.92839813,0.088931486,0.045817994,-0.30386972,-0.114867784,-0.3935937,-0.096220896,-0.6121138,0.20155105,0.45462435,-0.40676355,-0.05113691,-0.46387023,0.38810048,0.64982146,-0.5929771,0.56087756,0.4423287,0.032370128,-0.6682159,-0.19882739,-0.14751822,-0.45743653,0.7384448,0.11438975,0.3068199,-0.5263533,-0.46957314,0.37129882,0.6633979,-0.29952917,0.29409218,-0.8418826,-0.29989436,-0.9999239,0.5476275,-0.7638422,0.79235476,-0.6243428,-0.14704978,0.53217345,0.2856801,-0.4098524,0.70996463,0.34372687,0.4724214,0.2572987,-0.86103237,-0.5954791,0.93185127,0.2397043,-0.100462176,0.5762593,-0.27376255,-0.41281724,-0.69228524,0.598372,0.18012539,0.32737046,0.37858793,-0.19157025,-0.67336094,-0.35018805,-0.09470891,-0.013533942,0.7007109,-0.004996054,0.6538704,-0.003200127,0.5337287,-0.1382261,0.038107254,0.44292635,0.27318922,0.2348752,0.53261226,0.12976076,-0.12081445,0.6621566,-0.26333895,0.8008155,0.7340746,0.034020968,-0.18126811,-0.070369706,0.16608572,0.47989872,-0.3689622,-0.5968642,0.41959268,0.46872577,0.37411487,-0.010443832,-0.43019503,-0.06019549,0.31667295,0.9966745,0.107120745,-0.5857883,-0.34094408,0.7048087,-0.34911907,-0.33373967,-0.46589968,0.37497023,0.4639831,0.9810403,0.2297221,0.10431676,-0.21966243,-0.3544471,0.08518181,0.88138175,-0.13383283,-0.07529118,0.045182567,-0.26318166,0.066892564,-0.55545735,-0.7211925,0.70482564,0.99999976,-0.99361724,0.8034264,0.72262836,-0.24103932,-0.28819564,-0.5705272,0.20031941,-0.48240814,-0.5248739,-0.9990487,-0.2597106,0.9756386,0.7374931,0.11148682,0.5461595,-0.5487643,-0.48037887,0.7862729,0.7087314,0.06506807,-0.001951612,-0.9491751,-0.4385092,0.5127201,0.334441,-0.09883706,-0.3095713,-0.2568996,-0.04757793,0.65395826,-0.81965095,-0.38701028,-0.006551779,-0.46773627,-0.56818724,-0.68274456,0.26734075,0.12585197,0.75540286,0.3026902,-0.45953768,-0.3718414,0.07545981,-0.071552105,0.048714153,0.66771555,0.05730095,-0.24483997,-0.40385723,-0.1808095,0.031205524,-0.3012094,-0.96830106,-0.74200964,0.3238704,-0.7574373,0.12259859,0.13549885,-0.70342976,-0.64785373,0.99977005,-0.17173703,-0.51603365,-0.24965146,0.08321898,0.6870322,0.3791731,-0.89875245,0.60864747,-0.3656352,-0.5392695,0.624733,0.16177782,-0.42237088,0.192059,-0.5067169,-0.132743,-0.5515457,-0.99999976,-0.50299793,0.36218143,0.38238502,-0.08069067,0.6944131,-0.4294001,-0.20768099,0.5667094,-0.49227104,-0.2958707,-0.24992907,0.1853255,0.7787403,-0.8722457,-0.3643625,-0.5966822,-0.43329367,-0.069617905,0.44044533,0.52676886,0.1884457,0.011089282,-0.45516226,-0.7771538,0.81099737,0.5196404,0.004009319,0.40116096,0.8142105,-0.63661397,-0.5458368,-0.49199906,0.45869473,-0.72153187,0.5311604,0.114454105,-0.112129815,0.5722346,-0.39208657,-0.2252165,0.99994856,0.5672499,-0.92677873,-0.08611554,0.99964213,0.010979031,-0.29669747,-0.9994979,-0.35362738,-0.9285044,-0.09694025,0.46702334,0.39707264,0.12991932,-0.27052823,-0.5407493,-0.014751682,0.26399264,0.53321236,-0.62733155,0.63722855,0.60091573,-0.9999255,1,0.90043736,0.45105383,-0.66372484,-0.6270531,-0.035667222,-0.7416765,-0.13084547,0.048249505,-0.4114319,-0.5081387,-0.32280856,-0.369797,-0.22001895,-0.1096556,0.3674212,0.27160695,0.30088204,0.97832346,-0.9987447,0.46120873,-0.10095728,-0.16916732,-0.4249762,0.24786638,-0.92365676,0.45301488,-0.5825023,0.1730933,0.29504696,0.24411008,-0.43301013,0.96130997,0.8022353,0.87114954,0.2728458,0.36479855,-0.000154313,-0.12351313,0.2698845,0.52168685,-0.11969231,-0.6437814,0.51268256,0.89242786,0.6288257,-0.27493978,-0.030620737,-0.16499147,-0.13102363,-0.38200486,0.7297698,0.5022298,-0.41753954,0.999553,0.62798846,-0.21350233,0.5844202,0.31518382,0.50003135,0.9997821,-0.13334124,0.3598656,0.7796993,-0.44423452,-0.30928567,0.12741871,-0.9981357,-0.29033765,0.3878047,-0.07272561,0.30189323,0.12509468],
    [114,1,"CCCCCCCCCCCO",-0.6302213,-0.000402331,-0.017414402,0.48919204,0.16416742,0.47275215,-0.49399585,0.21875726,-0.062876515,0.037291553,-0.83304006,0.22351515,0.270663,-0.75904053,0.36462575,0.53121495,0.53547364,-0.32605678,0.27423757,-0.35093632,0.21557312,-0.7963939,-0.24583213,0.47422993,0.4829386,-0.008550274,0.114238046,-0.3841348,0.6519917,-0.36724687,0.23491216,0.81835693,0.61474633,0.097677834,0.1093616,-0.7050688,0.35839057,0.8284035,-0.72216386,-0.92597896,-0.98358786,-0.026921866,0.096824735,-0.10160387,-0.100541525,-0.99274224,0.58257663,-0.28611788,0.9660173,-0.040764503,0.8054511,-0.16387424,-0.12741947,0.21523483,-0.95438915,-0.10040081,0.9626599,0.986777,0.11430854,0.3366315,-0.60720265,-0.018472945,-0.20310895,0.559445,0.46041277,0.29181436,-0.36426052,0.39859933,0.23801182,-0.29658437,0.84621394,-0.8487428,-0.017851936,0.84372914,0.7652224,0.6303347,0.17798051,0.24431671,0.22212727,-0.9993286,-0.31918958,0.16878334,-0.53716445,-0.51689875,0.7246997,-0.2800626,-0.13147277,0.6927865,0.09716348,-0.45223027,-0.18364863,-0.3036465,0.36576077,0.14177825,0.6394272,-0.3519369,0.6194118,0.15327351,0.16614164,-0.7938536,0.3632721,-0.2909421,0.31235805,0.18813863,0.97982687,0.7565586,0.53077936,-0.122746624,-0.5507725,0.3340821,0.22849457,-0.21285836,0.78665274,0.55183035,-0.13355699,0.58625543,0.32497033,0.24136059,0.9940387,0.63418263,0.31979784,0.31593043,-0.038250513,-0.24116617,-0.052401725,-0.037564382,-0.06930434,0.13895759,0.17263739,0.9999135,0.35898334,0.7153171,0.024778474,0.3292616,-0.30954728,0.06588778,-0.031423815,0.26302683,0.26837066,0.3706507,0.99951833,-0.11905231,0.99526054,0.000243794,-0.5171753,0.061930556,0.53506964,-0.24778612,0.99557006,0.41615894,-0.20094638,-0.85791177,0.61795384,0.27666453,-0.24688311,0.030075504,0.24326792,0.99847764,-0.0624152,-0.7485792,-0.98070955,-0.5601109,0.621822,0.21803956,0.07005681,-0.28864416,-0.59153813,-0.5357216,-0.10036417,0.023999346,-0.048823714,0.019714866,-0.36451966,-0.14426565,-0.1270273,-0.9855216,-0.42757058,0.39510632,-0.55184335,-0.3301474,-0.21152356,0.6417628,0.30484384,0.4355083,-0.96948546,0.1801958,-0.03483225,0.45174214,-0.7126324,0.75670034,-0.6312337,0.47970173,-0.020506814,0.38998297,0.2988801,-0.5992807,-0.06646937,-0.46170497,0.4230893,0.4104316,-0.13702056,-0.6277983,-0.3720125,0.058110848,0.030219642,-0.101817235,-0.50770116,-0.5267212,-0.26743326,-0.7554911,-0.25665858,0.2963392,0.37927136,-0.75884455,0.29918942,-0.29277,-0.7449904,0.4687012,0.24645141,0.14311,-0.48646593,0.25383678,-0.3670457,0.040868755,0.996425,0.16340968,0.22875881,-0.50284815,-0.1627032,0.09770681,-0.10665692,-0.25701618,0.44892383,0.15578978,0.13568553,-0.43232006,-0.17114629,-0.37258285,0.34545437,0.0918754,0.8699606,0.14776075,-0.49935952,-0.34900895,-0.75918883,-0.26768187,0.06988439,-0.19620529,0.050303932,0.105364375,0.00987965,-0.99968684,-0.19075234,0.369384,-0.23990218,0.60268515,-0.2225961,-0.028765483,0.18658885,-0.3917185,-0.71214676,0.654643,-0.28165627,-0.6801502,-0.058755185,0.48232943,0.5043148,-0.67407835,-0.50645614,-0.41773304,-0.52425545,-0.92957777,-0.55778426,0.21468978,-0.30886558,0.044145532,0.39947087,-0.315434,-0.005389801,0.8345167,-0.48441806,0.9984245,-0.36503938,0.8459655,-0.5922362,0.57656455,0.17699105,0.50151545,0.58762556,0.41308975,-0.23988718,0.99866635,0.40829724,0.3406604,0.12184035,0.69790816,-0.99221563,-0.99503905,-0.3937136,-0.06292351,-0.13187358,-0.45397383,0.10701861,0.3457127,-0.13163143,-0.8871653,0.99615216,0.65912414,-0.30421552,0.19792211,0.16301998,0.22322764,0.18207128,-0.19585457,0.9543976,0.18217514,-0.5501441,-0.44985446,-0.99153525,-0.42832726,-0.14288658,0.520509,-0.06979958,-0.92944217,-0.22506264,-0.66479343,0.43038642,-0.9605438,0.32629722,0.47838262,0.06684452,0.4337312,0.2157912,-0.26165316,0.20916788,0.9026302,-0.2101473,-0.28923935,0.59887654,-0.13258255,0.41621044,0.29656982,0.36762205,0.7984417,0.17777897,-0.03390982,0.27687398,0.06214808,0.37557706,0.96304595,-0.99573016,0.096260294,-0.37326247,-0.42515802,0.074781455,0.48783743,0.062487986,0.995652,-0.5608017,-0.44131336,-0.11673444,-0.3842974,0.3998869,0.12517717,-0.52855843,-0.017027631,-0.66851956,-0.87023264,-0.35821012,-0.019037344,-0.31365493,-0.70269203,-0.854898,0.95166034,-0.2985089,1,-0.21176705,-0.045675654,-0.3002113,-0.1170194,-0.6476297,-0.112168625,0.76524067,0.060797315,0.4863197,-0.6244066,-0.27097237,-0.067890845,-0.5407542,-0.21585932,-0.4550063,-0.09399653,-0.6151012,-0.61251795,0.12985665,-0.9035749,0.5886523,0.07547405,-0.4384409,0.05766761,-0.9644501,0.02461915,-0.58088976,0.15752795,-0.08468458,-0.5767585,-0.27320844,-0.6151736,-0.38589257,0.31290296,0.6704543,-0.08069221,-0.055883035,-0.052254837,0.38296518,-0.43909112,0.99994904,0.29496205,-0.83720994,-0.16824442,0.98505235,0.002265781,-0.16354139,-0.9990813,-0.19013065,-0.3974422,-0.72831506,0.4681582,-0.060493663,0.405607,0.46590585,-0.8097271,-0.14575401,-0.40008947,-0.2760004,-0.18731163,-0.14958034,0.033008806,-0.99919724,-0.99999994,-0.98049474,0.32812324,0.028024416,0.7164815,0.22293499,-0.39008915,0.8568189,0.14498542,0.71551174,-0.114165895,-0.14767681,-0.27262712,-0.19459833,-0.21075195,0.18280223,0.16468509,-0.25970215,-0.9854051,-0.99911255,-0.7163651,-0.7630274,0.42075825,0.29707226,-0.5205494,-0.996732,-0.46017152,-0.68857193,-0.22511403,-0.49550316,0.118794195,0.1600227,-0.8173847,0.47811168,-0.333543,0.56027603,0.7627456,0.16105443,-0.8142031,0.32153583,-0.11376957,-0.6367971,0.259532,-0.6655383,0.5878401,-0.14132038,0.36747274,-0.33169752,-0.4778286,0.26852652,-0.8845799,-0.37335503,0.3562339,-0.4028031,-0.94691753,0.11402899,-0.50962013,0.14203873,0.26897874,0.35842785,0.9995315,-0.13590434,-0.3059133,0.6174538,0.576573,-0.42819104,-0.39563203,0.5043444,0.15741625,0.25330332,-0.4915776,0.8123579,0.11981113],
    [115,1,"Nc1cccc2c(N)cccc12",-0.7258572,0.030925944,0.609228,-0.37564954,-0.07855616,0.25009045,-0.6416494,-0.17458855,0.40091175,0.21914288,-0.71972525,-0.5649939,0.5166914,-0.6636959,-0.06645378,0.78972423,-0.022174576,0.15913895,0.40026802,-0.35239443,0.473502,-0.89208287,-0.10596611,0.41445538,0.3088838,0.4328792,0.22571167,0.32101828,0.04316322,-0.45531818,-0.15933794,0.43496764,-0.05017751,0.24022205,-0.42964447,-0.3439952,0.09270024,0.5717643,0.29442257,-0.94404465,-0.9303495,-0.6287408,-0.54882616,-0.3955971,0.32980946,-0.9960339,0.16463237,0.24611078,0.49909472,-0.14940482,-0.6152532,0.2800053,0.47553128,0.08847379,-0.9818633,0.15356961,-0.6748196,0.9486129,0.40672705,0.03323173,0.3945465,0.19716851,0.21981895,-0.39326954,0.5340605,0.2170567,0.2173231,0.47137854,0.52094126,0.15691975,0.023473596,-0.98735774,0.26420224,-0.6894102,0.49280742,0.033963,-0.20217852,-0.13972276,-0.010452661,-0.96653897,-0.84035546,0.4554994,-0.8243618,-0.2513986,-0.057825506,0.10000754,-0.19647475,-0.45165753,0.028330041,0.16617651,0.04092587,0.1568756,0.18341608,0.07051044,0.62432617,-0.39351067,-0.10241575,0.3365499,0.80491376,0.04048046,0.60704494,-0.5981584,-0.07378693,-0.825624,0.899679,-0.41056165,-0.35250482,0.2695261,-0.99880534,-0.21774024,-0.5692759,-0.030457672,-0.4140585,0.1876447,-0.35059786,-0.41974387,0.5090772,0.17516723,0.9993454,-0.22538948,-0.19318497,-0.4877213,0.14103477,-0.20858021,-0.06797074,-0.00786547,-0.7879194,0.09600175,0.10162848,0.99863786,-0.07601021,0.28015992,0.20962818,-0.19797713,-0.13538952,0.50989825,0.7770297,0.6728497,-0.7447085,-0.064513,-0.99960655,0.019780075,0.98699796,0.2545893,-0.014104242,0.66693634,0.17868729,-0.19565113,0.9932334,-0.60906947,-0.5317843,-0.4595262,-0.40452304,-0.08557131,0.1262854,0.09161378,-0.227718,0.99831647,-0.23016946,0.11518671,-0.9939529,0.12113736,-0.057532627,-0.19754441,-0.052575212,0.23409384,0.14735992,-0.032725543,-0.16517814,0.16282439,-0.89145905,-0.10391758,0.12556553,-0.33300182,0.1542564,-0.937576,-0.84504396,0.41643924,-0.57153517,-0.018813036,0.28214893,-0.6382549,0.20021439,0.06597998,-0.73234946,-0.6656559,-0.08534988,0.02443781,-0.31013703,-0.32068926,0.96689314,0.11533417,0.23075017,0.1716622,-0.17863098,0.48750022,0.29228708,0.46717942,-0.068125166,-0.51015705,0.219104,0.5497326,-0.4108011,0.38020507,0.5879451,-0.17378327,-0.07415693,0.24673969,0.6830962,-0.9631007,0.034958977,-0.3005127,0.19448029,-0.39317334,0.133132,-0.30802846,0.5718617,-0.035376225,-0.08563102,0.22203515,0.10009391,0.18706681,-0.6494866,0.005885713,0.99994475,0.3786909,0.65291286,0.15325703,0.13046315,-0.6235359,0.014798167,-0.2951336,0.10720855,-0.5906972,0.11791262,-0.60848045,-0.73479044,0.16181913,-0.49888703,-0.22748433,0.8985853,-0.30973318,0.19539943,0.062424764,0.6495293,-0.2563478,-0.31806803,0.57767797,-0.025748836,-0.5021373,-0.43310633,-0.96370405,-0.05478936,0.29831368,-0.51456565,0.06908829,0.32471204,0.54648244,-0.06752034,0.3525212,-0.64118403,0.3467955,-0.32563818,-0.64857453,0.4052038,-0.103352636,0.26744655,-0.39701784,-0.99793226,0.6894053,0.50292474,-0.5204207,0.30120847,-0.043133747,0.17810403,0.9065938,0.22971334,0.5979515,0.1806568,0.53916115,-0.09223983,0.9995369,-0.17383434,0.5723569,0.07336254,0.012647728,-0.25769675,-0.81266874,-0.3964214,0.10230566,-0.09072334,0.99930716,-0.014120221,0.8892615,-0.56820726,0.15573272,0.99994826,-0.90957355,0.008676832,0.015409809,0.001123199,0.61448634,-0.59401345,0.12666617,0.6979191,-0.72053725,0.9947118,-0.52031195,-0.7189784,-0.062053844,-0.1455855,-0.1429,0.66637033,-0.47579542,0.6364075,-0.045190673,0.27187708,-0.38582185,0.922668,-0.22209343,0.43425846,0.6259195,-0.34375402,-0.47166836,-0.46254772,-0.11467613,0.68258715,-0.88848895,-0.12676902,0.6272189,0.11132659,-0.3586417,0.03823755,-0.26799294,0.16139813,-0.11874099,-0.31098372,-0.0489446,-0.36067817,-0.34733343,-0.08296164,0.07747811,0.11719759,0.3313862,0.15135592,0.11126406,0.089006856,0.16207457,-0.3044559,0.9018038,-0.99599797,-0.08124918,-0.31744125,0.5683375,0.6120996,0.42834768,-0.45915064,0.99593246,0.43173134,0.05809158,-0.039252743,0.042933058,0.3093158,0.010861191,-0.66551816,0.3702379,-0.32327652,-0.20841654,-0.5276213,0.5755986,0.32697102,-0.117472485,0.7047231,0.9445672,-0.05211086,0.9986438,-0.18256553,0.39775932,0.027080674,0.20740056,-0.7795629,-0.38206396,-0.37265012,-0.65484554,-0.5702476,-0.45671862,-0.5049049,-0.2639466,-0.39151964,0.9136562,0.40406603,-0.1344415,0.010238007,-0.1461479,-0.46165434,-0.08368362,0.35036513,0.5850376,0.91507876,0.6258846,-0.8593891,0.29443136,-0.34692016,0.095924295,0.22014555,-0.4084225,0.14746778,-0.67553645,-0.49465638,0.10294197,0.7561362,0.32167956,-0.17264067,0.017593166,0.054071214,-0.09393446,0.95958793,0.14699776,-0.97829115,0.04304559,0.9995818,-0.49356738,-0.51586956,-0.95523417,-0.3227664,0.8059849,0.74350274,-0.062025666,-0.7362868,0.13506138,0.032082237,0.35292542,-0.07296462,-0.413983,-0.29892802,0.21250172,0.15446502,-0.12705357,-0.9999485,0.99413615,-0.9969539,0.2660631,-0.3578499,0.12488898,-0.002874629,-0.52950853,-0.7910649,0.5396211,-0.33521813,-0.5752806,-0.88073474,-0.39552212,0.09687476,-0.63305825,0.29924616,0.17031701,-0.47355375,-0.9786627,-0.99993265,-0.7757578,0.13764217,0.312823,-0.71595514,0.24113263,-0.9383206,-0.036747266,0.48594975,-0.2568286,0.44360164,0.33831617,-0.20962614,0.9743792,0.18254597,0.60849315,0.11335498,0.2228441,0.30075374,-0.8432137,0.04682624,0.68605846,-0.37828496,0.29402754,-0.055682696,0.40535772,-0.10587007,-0.30038777,-0.3180972,-0.06847706,-0.037565272,0.7199546,0.39590883,0.25253353,-0.13247676,-0.7567691,0.021976726,-0.2706475,-0.04961693,-0.40249863,0.30437437,0.9994481,0.31672198,0.33384874,0.2617042,0.31595233,-0.19157244,0.29702783,0.3442751,0.05987065,-0.6142954,-0.23608705,0.023236522,0.41638693],
    [116,1,"CC(C)(C)c1ccc(O)cc1",-0.81397116,-0.28251448,0.34914374,0.400279,0.11373075,-0.22523788,-0.67039156,-0.04288529,-0.10692128,-0.16914254,-0.8326566,-0.38226378,0.0629811,-0.5407458,-0.25316083,0.13292845,-0.23500475,-0.3209918,0.3129164,-0.37695134,0.27418113,-0.8823304,0.4079083,-0.12153493,0.090958245,0.6290522,0.37148562,0.20388399,0.7862623,-0.086803444,-0.36501664,0.5962875,0.34930563,0.36879998,-0.31371188,0.59546906,0.13342816,0.6936873,0.004823521,-0.96241367,-0.9986374,-0.19220573,0.16128474,-0.09839512,0.328306,-0.99639183,-0.045220952,0.03119829,0.97119164,-0.45808807,0.7136098,0.08376701,-0.44943744,0.18500334,-0.9685177,0.16434848,-0.51046556,0.95005643,0.42572436,-0.077069096,-0.16933618,-0.5996353,0.6021953,0.12025168,0.20423402,0.45247492,0.32254598,0.5863345,-0.102883026,0.5148919,0.86828345,-0.96248096,-0.23671125,0.47926873,0.61687386,0.34970364,0.17993832,-0.42461148,-0.16330163,-0.9980027,-0.7193404,0.42655662,-0.7315319,-0.37074396,0.31204453,-0.15188842,-0.04339813,-0.4308493,-0.034650903,-0.14104523,0.2859083,0.17048031,-0.17414409,-0.42467695,0.12578234,-0.27174443,0.45433715,0.16091408,0.57302046,-0.35676554,0.29804707,-0.07964089,0.013274006,-0.40826955,0.9194134,0.4656552,0.25099722,0.69878477,-0.9032709,-0.1173139,-0.014390487,-0.28039524,0.12749124,-0.32258368,0.16137835,0.6325815,0.29706827,0.1710368,0.9991433,0.048046913,0.28217867,-0.17824921,-0.30845833,0.25852507,-0.52398294,0.12419129,-0.29141238,-0.21588816,-0.47467378,0.9996642,-0.24407399,-0.037474986,-0.21257798,-0.23827474,-0.6736239,-0.45663157,0.3776467,0.6434236,-0.7870568,-0.34404537,-0.9977164,0.344287,0.99576247,0.57277584,-0.12540765,0.09805641,-0.019857813,-0.46579266,0.99460506,0.19458276,-0.025573209,-0.7109293,0.26520175,0.30962965,-0.4354632,-0.42567202,-0.062406853,0.99893296,-0.6361703,-0.5690786,-0.99209976,0.4753829,-0.2658382,0.34946832,0.08780899,-0.08234534,0.8065896,0.6233434,-0.008694984,-0.33656636,-0.69158274,-0.15318094,0.26777163,-0.28717956,-0.186695,-0.9912754,-0.8301501,0.16513154,-0.6062201,-0.34230286,0.20400389,0.56825364,0.042341683,0.38309863,-0.90600336,-0.098081015,0.7356536,0.22409588,-0.1624686,-0.24884295,0.63042855,0.3945663,-0.06647135,0.46358857,0.3641528,-0.6074269,0.37351173,-0.40836418,0.29008675,-0.2939791,-0.5562929,0.24271898,-0.15714708,-0.3456328,0.20423038,-0.1541686,0.49030593,-0.28058597,0.054688495,-0.87814766,-0.3903372,-0.07200467,0.4029247,-0.32934594,0.57823807,0.57215667,0.08763198,0.21066657,-0.29525676,0.2608074,0.073487885,-0.500232,-0.0889629,-0.43000337,0.9987624,0.24247578,0.07405039,0.014440704,-0.14419216,-0.044806883,-0.26799086,-0.41651335,0.72603947,-0.028265819,0.20674276,-0.39092174,-0.08391781,-0.16166312,-0.14699313,-0.040796917,0.92970073,0.36724308,-0.030712368,-0.7331396,0.37503168,-0.10440722,0.020185834,0.3319697,-0.5173285,0.026428388,-0.18557997,-0.99779,-0.55678093,0.5936151,0.4720297,-0.5012144,-0.6179274,-0.023395417,0.49712324,-0.114333704,-0.67705446,0.7666587,-0.46622086,-0.55764836,0.59965086,0.07720987,0.44285557,0.5197359,-0.52521366,0.43876937,-0.5029665,-0.8386553,0.2962458,0.39933312,-0.3855686,0.30561757,0.00808345,-0.11737018,-0.31377813,-0.31173897,0.19280528,0.9994646,0.09743546,0.45223668,0.17816561,0.008985023,-0.32617098,-0.11803253,0.72689706,-0.07945302,0.3801301,0.9994817,0.18446086,0.8098663,-0.05715062,0.15429339,0.99838233,-0.97721094,0.3594814,0.012966348,-0.17489024,-0.07298642,-0.15005796,-0.39429814,-0.10186172,-0.67050105,0.99716794,0.19029072,-0.41289914,-0.026909359,0.12764634,-0.19159506,-0.24769327,-0.37522435,0.923103,-0.30728132,-0.1992357,-0.37734005,-0.97893155,-0.14418119,-0.0393928,-0.02696694,0.5504493,-0.6023163,-0.48143807,-0.3996065,0.14550824,-0.9693351,0.02759349,0.383704,0.008388913,-0.28109506,0.35805246,-0.26567048,-0.122903675,0.50430477,0.1999095,0.12187021,-0.38304827,0.014531016,-0.30273363,-0.31043825,0.4441925,0.7157381,-0.30198842,0.353814,-0.3249993,-0.6044815,-0.10450677,0.93482393,-0.9959566,-0.32955575,-0.7758269,-0.23852247,0.18934146,-0.36837038,0.3515357,0.99366504,-0.099292815,-0.46710357,0.09389338,0.023483021,-0.47469392,0.29046497,-0.7692463,0.22518705,0.060643848,-0.40237424,-0.09988423,0.34568715,0.62157637,0.15083604,0.17475587,0.97106487,0.42560267,1,0.05927045,-0.599063,-0.36351463,-0.47000292,-0.9221675,-0.6141093,0.005050553,-0.5229611,-0.030772805,-0.36732495,0.41438696,0.20529073,0.18413812,0.7207753,-0.010706851,0.19716413,0.017398795,0.2822151,-0.017567467,-0.39828506,-0.3393668,0.2022742,0.80409217,0.02708839,-0.97645986,0.39900127,-0.15523823,0.12927885,-0.17376527,-0.41717872,-0.77502793,-0.52604324,-0.56327057,0.014322539,0.562997,0.31247953,-0.41118112,0.31626874,0.17554562,-0.26625347,0.9999521,0.24027216,-0.9931775,-0.26708663,0.99895823,-0.6144165,-0.17918926,-0.9980932,-0.27841696,0.6858568,0.42716223,-0.03791722,-0.7920735,0.53976876,0.42231467,-0.124906324,-0.5819706,-0.20325924,-0.36083817,-0.035117935,0.016326608,0.044064634,-0.9999242,-0.9993939,-0.9926792,-0.16786337,-0.58159757,-0.039750185,-0.073516555,-0.5407947,-0.75689155,0.06985477,-0.25847298,-0.3501709,-0.7786192,-0.62295985,0.2866433,-0.33066055,0.54123604,0.24127775,-0.26911217,-0.9837015,-0.9999201,-0.47031775,-0.2943204,-0.23243587,0.23438372,-0.34857306,-0.996131,0.1139322,-0.545091,-0.0277106,-0.07053027,0.31647742,-0.20889881,0.9472115,-0.20121968,0.85246843,0.58096063,0.36758703,0.15390165,-0.87957555,-0.03546405,-0.041782733,-0.45079693,0.027743747,0.14771852,-0.16668634,0.025939101,-0.5578579,-0.2563915,-0.62232244,0.15548071,0.5144233,-0.12796445,-0.47601682,0.07391132,-0.8885466,0.4032629,-0.17813678,0.09375026,0.18256408,0.3124597,0.9993464,0.41294405,0.30706394,-0.003320958,0.42194098,-0.057641644,-0.31949612,0.59307665,-0.190383,0.14332981,0.24272059,0.7728206,-0.22604641],
    [117,0,"COc1ccc2sc(C(=O)N=c3nn[nH][nH]3)c(OC(C)C)c2c1",-0.3724345,-0.67105466,0.09082752,-0.47175887,-0.030739103,-0.135291,0.8599651,-0.1048986,0.45438662,0.80007845,0.48730683,-0.19082332,-0.11439608,0.43781716,0.87154895,-0.535155,-0.22700782,-0.26079613,-0.33639526,0.003417948,0.75714815,-0.21764457,-0.00428465,-0.04099441,0.71452683,0.4762174,0.5927176,-0.27078822,-0.57510674,-0.26862887,-0.12976527,0.06332338,-0.9178114,0.17453429,0.72374916,0.50843143,0.7165413,-0.75908023,0.99807924,0.19237003,-0.8710373,0.6536578,0.7667602,0.5433155,0.10936098,-0.41545236,-0.5585405,0.49007446,0.7643889,0.4184196,-0.035305813,-0.089547984,-0.4937325,0.50875294,0.40902072,0.05347196,-0.7960628,-0.49785492,0.108094215,0.6978622,0.4933957,0.47849858,-0.038150173,-0.52815247,-0.24184033,-0.38603318,0.57111055,-0.5409043,0.42708203,0.25505945,-0.97508705,-0.99831337,-0.48774076,-0.76586246,0.20557566,-0.59924656,0.24724725,0.12691584,0.5741084,-0.9992506,-0.4708728,-0.4845945,-0.9541483,0.46727452,-0.4439708,0.03790546,0.17869166,-0.5517302,0.44387966,0.82892644,0.16159303,-0.8706335,0.75784415,-0.55270034,0.99991614,0.123798616,-0.5108133,0.1763693,-0.15313056,-0.31301156,0.71803695,0.49841404,0.2000827,0.5638655,-0.9881064,-0.93229795,0.34289634,-0.262887,-0.99993944,0.19196153,0.001761286,0.5710944,-0.51281697,-0.7533014,-0.26908946,-0.47200286,-0.77603906,0.4646163,0.9928062,-0.41268665,0.5669605,-0.11071973,-0.351419,0.016338373,-0.29204953,0.84981215,-0.0005114,-0.14016952,-0.32392237,0.9774068,0.85134053,-0.2542495,0.28796387,0.44384903,-0.13059275,-0.99537367,0.38516507,-0.09518215,0.17374761,-0.182202,-0.9999995,-0.14879075,-0.28076383,0.13834038,0.3699764,-0.34298143,-0.9050319,0.5109102,-0.8722859,0.30891848,-0.055479843,-0.20099461,-0.41562745,0.63051003,0.19189079,0.6538061,0.37572238,-0.1859956,-0.50802815,0.08815831,-0.8411189,0.7157398,-0.25652394,0.3402972,-0.3822524,-0.15681219,0.09320691,-0.53172576,-0.11510502,-0.09828006,0.063887246,-0.45867488,0.73594964,-0.54754704,0.30475435,0.66795355,-0.2775014,-0.46306947,-0.43854064,0.6229201,-0.17747317,-0.987862,-0.15601759,0.47884163,0.3983731,0.42219907,0.56515056,-0.46205807,-0.057327237,-0.3455963,-0.033483602,-0.529572,0.000113074,0.080087714,-0.85362387,-0.10834085,0.24151808,0.24708678,-0.58671296,-0.63614005,-0.4212105,-0.15752214,-0.616912,-0.26903677,-0.7382858,0.29882124,0.08886092,-0.3346172,0.2915096,-0.9997355,-0.2516074,0.13440855,-0.928283,0.59875995,-0.36993438,-0.13479237,0.72197306,0.2742218,-0.21430509,0.6105556,0.5857663,0.7244252,0.06672014,-0.542614,-0.93034315,0.57033277,-0.29372236,0.4886433,-0.61312145,-0.14023192,0.55844736,-0.29938382,0.5905339,-0.63796216,-0.016177747,-0.64707804,0.42503697,-0.7038816,-0.02924197,-0.27857438,-0.9946369,-0.04409259,0.7571657,-0.14521378,0.39324573,-0.09819487,0.26146394,0.6721979,-0.47429278,-0.3285525,0.90806925,-0.80410796,-0.23876141,-0.14719187,-0.013926084,-0.44577295,0.21249181,-0.40304342,0.16793449,-0.6801414,-0.14216776,0.5211185,0.5863934,-0.11648621,0.31400833,-0.7603426,0.08124976,0.03918439,0.7227896,0.13791876,0.28024006,0.9943695,-0.08092901,-0.42311484,-0.61591136,-0.74055517,0.38707876,0.80598634,-0.06644637,-0.06414459,-0.3270424,0.99611855,-0.02694743,0.24843691,-0.14804713,0.3324478,-0.65566826,-0.7903289,-0.89970815,0.50964767,0.5957758,0.91517466,0.31721306,0.8747381,-0.37131396,-0.3819797,0.99999976,-0.6368395,-0.15566282,0.27833977,-0.5924115,0.15719213,-0.38132572,0.1738149,0.9272991,0.3152994,-0.95320565,-0.17428778,0.2519387,0.15617803,-0.10995453,0.33867946,0.13036327,0.077033915,-0.47133014,0.67466104,-0.6216239,0.72820085,0.9371711,0.16405022,0.3461776,-0.2245642,0.41705337,-0.43852392,-0.112951264,-0.4211181,-0.14757302,-0.69140065,-0.7449534,0.23034272,0.06380579,0.35487452,0.12927775,-0.73597026,0.59465486,-0.84461325,0.3108091,-0.5133951,-0.37925977,-0.8755719,-0.014600305,-0.5380204,-0.3708932,-0.036802176,0.22730348,0.12959768,-0.8804983,-0.6815828,-0.60551816,-0.8884076,-0.8324366,-0.35069913,-0.5936348,-0.5913499,0.046832524,-0.5904663,0.47973636,0.99951774,0.36446002,-0.4809853,0.276297,0.41676095,0.042550355,-0.1522267,0.32412377,0.21717435,-0.16887407,0.45801926,-0.1539292,-0.10943616,-0.012439297,-0.45999157,0.4482576,-0.86166227,-0.22251739,-0.9876011,0.19584373,0.56551594,0.3690936,0.45310575,-0.15658647,0.03600742,-0.68833464,0.002747905,-0.42826295,-0.32897255,0.13982098,-0.012420706,0.537961,0.53796,-0.39559668,0.8419313,-0.10775037,0.3768746,-0.62240183,-0.29225776,0.61429524,0.4641993,0.74332386,0.7603184,0.98386097,-0.6826162,-0.25792164,0.45923254,0.12235896,-0.11784635,0.6095587,0.8021083,0.12994912,-0.6088469,-0.40956405,0.2554725,0.3484606,-0.18392327,0.26129943,-0.23441064,0.965309,-0.7302124,-0.95750886,0.026603483,0.99923986,-0.5029521,-0.6190908,-0.9657995,-0.17776243,-0.52174526,0.030693829,-0.038724363,-0.57985157,-0.08196101,0.21583211,0.4087645,0.14328751,-0.040986262,-0.21553747,-0.17253394,-0.4551083,-0.832619,-0.9999724,0.9999998,-0.51244307,-0.7175047,-0.7681701,-0.81318986,0.110419914,-0.10503444,-0.86357754,-0.14042075,-0.09151571,0.6864589,-0.110453896,0.67988443,-0.38117117,0.41014576,0.79101294,-0.063988246,0.36654705,0.3655017,-0.9998423,0.13976747,0.3549898,0.17937541,0.09307501,0.70921826,0.63245934,0.4497881,0.06790418,-0.13961202,-0.5583341,0.55332655,-0.75590736,0.9916792,0.53457785,0.32126808,-0.18705131,-0.011275914,0.57514083,-0.106397554,-0.27358994,-0.54919827,-0.6572701,0.7750158,-0.32407776,-0.21784241,0.047120433,-0.18155625,0.4980284,0.08274678,-0.2885965,0.64004165,0.2034905,-0.29462892,0.23018278,0.99480826,0.12851885,0.1565875,-0.36684868,0.42140695,0.46111128,0.9995358,-0.033238076,-0.3215975,0.009399684,0.23821726,0.023705352,-0.73143023,-0.99815756,-0.56201094,0.03210428,-0.73531914,-0.5323232,-0.75966334],
    [118,1,"CC=C(c1ccc(O)cc1)C(CC)c1ccc(O)cc1",-0.6877484,0.2547801,0.18462369,0.4120649,0.67758226,0.4297586,-0.529437,-0.03680466,-0.11528807,-0.23569502,-0.8460656,-0.3169233,-0.46890476,-0.7757261,0.43120572,0.30159596,-0.35643926,0.15135354,0.09254343,0.071876705,0.26843905,-0.5721893,0.43436342,-0.291752,-0.43890518,0.36252147,0.16249108,0.29631594,0.76404595,0.109229214,-0.33715487,-0.45987782,-0.3275042,0.27336589,-0.31042755,-0.20541818,0.20637226,0.36974385,0.9953857,-0.7871112,-0.29171228,-0.21594563,-0.64230037,0.12862565,0.123408705,-0.8525057,0.58410615,-0.30794147,0.97128755,0.4715702,0.35552138,0.2571918,-0.22409676,0.38981366,-0.8925783,-0.08858978,-0.5985771,0.41682348,0.057039253,0.4429061,-0.69242096,-0.29464877,0.28659534,-0.4925898,-0.19887736,0.008476601,-0.75933135,0.44442385,-0.024435803,0.02879062,0.37097815,-0.16580452,0.20846082,0.07151367,0.912813,-0.14560974,-0.4397824,-0.27767366,-0.26387873,-0.99723035,-0.88727486,0.08872602,-0.8567876,-0.26046714,0.03073077,-0.9066431,-0.60080177,-0.07665961,-0.48074695,-0.40778986,0.7339534,0.21492384,-0.3700429,0.13051121,0.7371392,0.040977776,0.6963552,-0.16359161,0.2718169,0.44597146,-0.21292564,0.39176077,-0.48880354,0.89457995,-0.96323246,0.5731997,-0.15939204,0.34421518,-0.99942195,-0.37529254,-0.40662757,0.023687445,-0.26723787,-0.04612298,0.21819952,0.22744466,0.06267885,0.53642976,0.99464685,0.25782323,-0.5165913,-0.2887811,-0.31220195,0.31057894,-0.7146438,-0.045741912,0.35939762,0.25197798,0.1617223,0.99994284,-0.09651608,0.34002483,-0.49617964,0.15732308,0.28071725,-0.74565977,0.7016562,0.8135603,-0.78506446,-0.5805015,-0.99991864,0.16383976,0.9794883,-0.063457474,0.39157593,-0.22732736,-0.42703587,-0.2118119,-0.582224,-0.070589475,0.087983586,-0.9195131,0.7340248,-0.35535187,0.22110929,0.35531422,-0.057890836,0.7057251,-0.7796315,-0.20085777,-0.93909997,-0.111573346,-0.11003161,0.17030272,-0.27517608,0.31557795,0.7823768,-0.30532333,0.04680767,-0.6647964,-0.075704254,0.004632717,0.26961485,0.19009605,-0.449107,-0.9561555,-0.8528741,0.14434385,-0.18634644,-0.6520483,0.10309456,0.24699676,-0.26620263,0.7905186,0.3440135,-0.10836538,0.10502733,0.5237732,-0.38420504,-0.0975493,0.000458002,0.0893325,0.46514344,0.74094945,0.18177792,-0.57025933,-0.012714807,0.6214176,0.28011516,0.40826675,-0.1532484,-0.38158765,0.36541834,0.19985312,-0.011369329,-0.14134143,0.56729805,-0.13801785,0.2892413,-0.9998394,-0.07737285,0.5377979,0.43496925,0.027973419,0.3967934,-0.39039528,-0.11486397,0.21188511,-0.7915605,0.13021103,0.52207124,-0.23933022,-0.5878452,-0.14991836,0.9998527,-0.24608584,0.024354964,0.37745392,0.22740185,0.44560218,-0.6710083,-0.7481799,0.19857748,-0.2707424,0.46955633,-0.22436693,0.1061044,-0.3750423,0.5790643,0.47090816,0.7612941,0.7693194,0.4425792,-0.51327467,0.10682911,0.39461052,0.5706425,-0.11530716,-0.77689356,0.07713125,-0.22829163,-0.9736441,-0.52604383,0.587268,0.5224193,0.051877845,-0.5663306,-0.37903744,0.23987834,0.35597175,-0.65963787,0.49981233,-0.37890607,-0.09048191,-0.19808644,-0.18489005,0.41137812,0.3529146,-0.6298432,0.43825036,-0.67415005,0.9937145,-0.113403745,-0.005393974,0.36646703,-0.42398232,0.07656998,-0.48816854,0.04000942,0.27519625,0.7008564,0.9986575,0.1937255,0.21873817,-0.015703589,-0.23576231,0.41272104,0.12924391,-0.42468327,0.13360307,0.19785911,0.9792222,-0.373149,0.32857943,-0.48547104,-0.8860093,0.9999686,-0.99745893,-0.40874875,0.45827726,0.5187712,-0.16956024,-0.6195966,0.29278097,0.033185903,-0.9806822,-0.56627846,0.11485214,0.4621276,0.073917545,-0.34775034,-0.6241743,0.27500856,-0.46737084,0.81797737,-0.63168424,-0.60762805,0.2807657,0.9703156,0.21694018,-0.3118412,0.15183945,0.20098396,-0.66044384,-0.6090361,-0.18902496,0.39685786,-0.9155981,-0.07573927,0.23908333,0.33394137,-0.21283863,0.28074494,-0.32254958,-0.31426477,0.9160241,-0.13074018,-0.38452545,-0.023377016,0.20044234,-0.23209181,0.38691056,0.2624492,0.425728,0.3431943,-0.008708414,-0.35536695,-0.66608256,-0.24501464,-0.2013454,-0.9720685,0.33995828,-0.556414,-0.122620754,-0.38551363,0.3642884,0.6159169,0.99985975,-0.115431316,0.34951872,-0.19373813,-0.23488365,-0.251815,0.47913286,-0.9465855,-0.27823436,-0.35589936,0.08632233,0.22079638,0.791055,0.08680119,0.1678063,0.18733,0.6881775,0.4560878,0.99370706,0.75882,0.3977849,0.1673834,0.3486986,-0.7570035,0.36059305,-0.6337199,-0.7687333,-0.14901064,-0.06916158,0.4352815,0.20093851,0.27104473,0.27405202,-0.19825082,0.45194986,0.05713236,-0.24707212,-0.010310052,-0.5791164,-0.7260553,-0.8998836,0.58000946,-0.45974547,-0.80641294,0.48074177,-0.27595547,-0.043724112,-0.43350682,0.000600128,-0.17730539,-0.62807393,-0.28935722,-0.113696195,0.35895327,0.6318122,-0.41198424,-0.058031492,0.4686103,-0.2874234,0.85283905,0.34216365,-0.9119075,0.017659327,0.9992335,-0.33666164,-0.32236508,-0.9795498,0.39083385,0.29958493,0.62778735,0.01885558,-0.33916828,0.6708562,-0.74544215,-0.8370431,-0.35474643,0.24815254,-0.4595408,0.49207473,0.6852676,0.19678693,-0.9999684,0.99350333,-0.7386689,0.3908855,0.5330664,0.41937009,0.45721924,-0.8270393,-0.3454296,-0.33232263,-0.054327637,-0.08728366,-0.79039776,-0.29367918,-0.345895,-0.5990096,0.2539302,-0.53598773,-0.07623021,-0.021786705,-0.99989176,-0.6329395,-0.29502675,-0.46399376,0.74306375,-0.032153945,-0.9871785,-0.23027846,-0.7955243,-0.09676938,-0.60830724,-0.001983519,-0.5744231,0.9272097,-0.22527725,-0.5613374,0.064223915,0.6823188,0.14067413,-0.91718984,-0.5555345,-0.2894718,-0.50001043,-0.54080033,-0.98718375,-0.12939115,-0.24973935,-0.11986052,-0.19555609,-0.6076757,-0.22520842,0.5683963,-0.15546504,-0.25115025,0.35015413,0.9753205,-0.1335522,-0.25564834,0.5583885,0.2642931,0.22355384,0.9997792,0.45410526,-0.6174014,0.10412855,0.46887338,0.58980423,-0.296855,-0.98930573,0.120113336,0.7843053,-0.073910095,0.18098308,-0.08505255],
    [119,1,"C#CCOS(=O)OC1CCCCC1Oc1ccc(C(C)(C)C)cc1",0.4860331,-0.17772499,-0.4962129,0.76253074,0.68289214,-0.33533406,-0.4234433,0.455609,-0.16701259,-0.114268705,0.5470432,-0.57545704,0.22125693,0.58986586,-0.022391593,-0.35814977,0.06354485,-0.054335658,0.15357898,0.070562944,0.5580111,0.16636637,-0.3367274,-0.28460503,0.120271206,0.5890969,-0.4617035,0.40551755,0.34587815,0.50118005,0.05096244,-0.12063765,-0.10508433,0.14821205,0.4614315,0.5433094,0.06295223,0.27654257,0.99920446,-0.6692312,-0.30892655,-0.67907107,0.4886885,0.47537696,-0.34779993,-0.038946792,-0.71551895,0.50969416,0.9887064,0.38160652,0.7912064,-0.18812461,-0.74443406,0.67158407,-0.3509267,-0.15186803,0.44040275,-0.40559524,0.59959716,-0.00099874,0.4718954,0.63189834,0.12520465,-0.08775065,-0.2901016,0.010499328,-0.43052825,0.48799545,0.17214835,-0.28160343,0.24688716,-0.67366016,-0.003080626,0.47855908,0.69543046,-0.1569447,-0.23868906,0.040533945,0.068402365,-0.99983025,0.46254236,-0.3876906,-0.8999634,-0.55376935,-0.7186441,-0.9000367,0.20894852,0.08110431,-0.31943724,-0.6944247,-0.24244198,0.6584622,0.059397995,0.071208514,0.998301,0.18159848,0.3635988,-0.2759591,-0.6762976,-0.71404165,0.17115061,-0.009317363,-0.41407531,0.9516068,-0.99584514,-0.55893975,0.71498394,0.7445532,0.9708187,-0.14122897,-0.3640727,-0.106031165,0.04209317,0.4271818,0.49075484,0.048037082,0.7753027,0.75753796,0.97801375,0.5418574,-0.59328395,-0.18386057,0.7124308,0.28904918,0.42183933,0.57461923,0.33751804,-0.74290943,-0.29150033,0.9998453,-0.464106,0.38893998,0.6117263,-0.33091962,0.53617406,-0.98692864,-0.6007021,0.17357333,-0.25285378,0.11966148,-0.99997705,0.6515393,0.81232303,0.2587922,0.4260372,0.5025176,-0.65646404,-0.6601607,-0.9748768,0.615997,-0.13861552,-0.82828456,0.5530272,0.5937994,0.37306526,0.6087278,-0.0508271,0.024789197,-0.4419347,-0.92430854,-0.66575444,-0.51944953,-0.3140526,-0.11811609,-0.30473867,-0.1277312,-0.14103135,0.49433658,0.16899966,0.23552307,0.14321107,-0.2816118,0.6504663,0.053074438,0.7031462,-0.8540418,0.7153209,0.20164925,-0.33989593,-0.71750885,0.53639686,-0.8424662,-0.07859618,-0.10658378,0.4098423,-0.48251253,0.21354704,0.50520957,0.3558297,-0.19434164,-0.75398535,-0.2694703,-0.27529272,0.5801326,-0.30168465,0.27302673,0.52425116,-0.8125428,0.64180046,0.1645918,0.33574283,-0.6179139,-0.13309066,0.38786486,0.52639854,0.018060012,-0.46770832,-0.77581143,-0.16105843,-0.99994624,-0.37851724,-0.27597648,-0.006939884,-0.008228093,0.5642178,0.6347887,-0.3985228,-0.60702896,-0.5820817,-0.22284772,0.2047464,-0.4653815,-0.014800302,0.47649306,-0.9800894,0.123298734,-0.41273403,-0.48169804,-0.2258537,0.23305425,0.07356311,-0.16661252,0.14153741,-0.1768156,0.58785236,0.67690176,-0.48578545,0.55699426,0.41315797,-0.6936978,0.8517005,-0.49896723,-0.70081055,-0.31543285,-0.06001108,-0.4223776,0.41369665,-0.026857765,-0.38835943,0.43458915,0.56743956,-0.9624889,-0.47242793,0.6992789,0.22347903,-0.3152493,-0.47340822,-0.065871805,-0.45423993,-0.57028115,-0.34642988,-0.7283429,-0.15807748,0.36013758,0.29921654,0.4171172,-0.1350139,-0.19301164,0.9678927,0.11598147,0.011816585,0.9996607,0.420558,-0.480276,0.3766574,-0.8123229,-0.28471747,-0.5537552,0.1025771,-0.21997647,0.1245792,0.9948177,-0.58311754,-0.3358692,-0.9140694,-0.3282957,0.7163772,0.92035675,0.7976563,-0.30621955,-0.20181942,0.8902367,-0.19878949,0.4109999,0.20683604,0.2592642,0.9999739,-0.99484926,-0.31124607,-0.32333726,-0.298115,0.18031657,0.22858027,-0.5902415,-0.2776376,-0.67101926,-0.9429827,-0.2517477,0.8065346,0.7807153,-0.5198493,0.16345243,-0.27240813,-0.49496314,0.4692488,0.11363162,0.37082845,0.17763978,-0.99983126,-0.114077665,-0.32217017,0.26911706,0.5901662,-0.6947476,0.27669436,0.52915114,-0.070596255,-0.45080242,0.33403495,0.5062767,-0.32614952,0.38628164,0.10554834,0.21575123,-0.15451224,0.75038236,-0.01752478,0.85961884,0.65349627,-0.09411115,0.03268057,-0.19336276,-0.18313612,0.7640177,0.054786325,-0.031604815,0.49672717,0.274196,-0.2358453,-0.82139367,-0.9088434,0.044128854,0.51954216,-0.36697894,-0.10558401,-0.39560452,0.5979232,0.9997146,0.3899247,0.26578206,-0.33689997,0.66364014,0.699322,-0.42917538,-0.6855271,-0.6366224,-0.6343209,-0.6907444,-0.07424443,-0.001142539,0.17713895,0.36882624,-0.050085746,0.004143266,-0.41010138,0.992915,-0.33600983,0.22728448,0.3518041,0.6546575,-0.30517635,-0.475877,-0.12803593,-0.002996767,-0.32795733,-0.6566747,-0.083831914,0.19380218,-0.040075112,-0.6534921,0.06689288,0.05322474,0.21703203,-0.6237395,0.7358554,-0.6889671,0.7529419,-0.02590447,-0.29376534,-0.38095433,0.49091065,0.16828965,0.673641,-0.09232369,-0.50041413,-0.51871794,-0.1663833,-0.29449934,0.5397379,0.1929112,-0.563097,0.5340765,0.40011647,0.462072,-0.37102604,-0.064524874,0.99999934,-0.5046394,-0.9634802,0.01925609,0.998175,-0.55934834,-0.17923696,-0.9998516,-0.10280859,-0.9284904,-0.058609243,-0.5303053,0.1401849,0.3833268,0.11421254,-0.5235628,-0.43986902,0.57769436,-0.29233605,-0.607027,-0.44040415,-0.48513258,-0.99993217,0.9913943,-0.27256906,-0.6413914,-0.4223807,-0.73351693,-0.53198487,-0.46360636,0.6019299,-0.36462954,0.2207053,0.59045005,-0.5997125,0.2371117,-0.01728822,0.7194772,0.05406025,0.2009331,-0.42639378,0.7056486,-0.9995023,-0.1587161,0.021435961,-0.017232124,0.32324538,-0.12986009,-0.8998446,0.34664693,0.66428447,0.7915659,-0.26851603,-0.60160106,0.7073133,0.8780765,0.030461673,0.05279043,0.7605954,-0.00233096,0.21575414,-0.04934289,0.4114724,-0.19828233,-0.11558901,-0.37721023,-0.99602354,0.058485102,0.37946838,0.06763631,0.27142364,-0.6006832,-0.006011888,-0.6964698,-0.611595,0.8582561,-0.17043142,0.9965218,-0.16595526,-0.43547413,-0.010111139,0.021948049,-0.18205377,0.99996907,0.22480942,0.011875733,-0.75932664,0.26404697,-0.1851521,-0.121866524,-0.9974622,0.3335045,0.30215707,-0.341213,-0.03601917,0.61658597],
    [120,0,"CCCCCCC(C=O)=Cc1ccccc1",-0.1948033,-0.60307646,-0.067205414,0.31051946,-0.53285134,-0.2632858,-0.06305453,0.5183224,0.623158,-0.05582357,-0.6653327,0.18025364,0.5652386,-0.9334942,0.7819108,0.24968457,0.77254194,-0.2220399,0.25870878,-0.24629508,0.64421046,-0.82476074,-0.49928337,0.44832468,-0.2542531,-0.063261546,0.5717226,0.17516701,-0.42563462,-0.42393655,0.594608,-0.13034002,0.44164047,0.18950176,0.15708068,-0.21352574,-0.16487531,0.8290334,0.8695169,-0.78243554,-0.9786961,-0.27323723,0.12856194,-0.28872937,0.75795126,-0.9783598,-0.19591123,-0.55765074,0.99903905,0.03157434,0.43981698,0.6757992,0.3608125,0.32932502,-0.9276186,-0.17135197,0.60213876,0.9244129,0.460882,-0.1284869,0.026418116,-0.033077173,0.15762304,0.34068274,0.06819311,-0.2794178,0.25658727,0.6339915,-0.4325109,-0.12345149,0.94713295,-0.72457856,0.06359065,0.44210982,0.71560436,-0.0646118,-0.46177498,-0.09066753,-0.5418384,-0.99926627,-0.052547578,0.31587732,-0.78557783,-0.37922612,0.3698691,-0.75092906,0.046530962,-0.22445002,-0.33974737,-0.020983694,-0.078140125,-0.08566132,0.3758952,-0.047817387,0.81827736,0.2386229,0.6840868,0.3282533,0.52669466,-0.3828461,-0.056221165,-0.29628527,0.45445806,0.7926231,0.1476811,0.41430596,0.28741074,-0.09819008,0.98082864,-0.5631145,0.573736,0.2385021,0.11658696,0.63211286,-0.38739067,0.5316067,-0.016872592,-0.42578462,0.997581,0.015439712,-0.36281592,0.021746477,0.46906376,0.0925615,-0.41505104,-0.26369402,0.23860092,0.3027476,0.065102555,0.9999578,0.39831945,0.6108156,-0.21799703,-0.3932411,-0.77350944,-0.93270993,0.08313543,-0.29109314,-0.6322087,-0.071577325,-0.9978631,0.09159328,0.9888609,0.034327045,0.37915573,0.19156225,0.054958448,0.05456468,0.8531212,0.7470344,-0.055725247,-0.8975783,0.75085115,0.47443262,0.25189155,-0.1964648,0.6090546,0.99246734,-0.42089203,-0.949127,-0.97641706,0.33061418,-0.005300441,0.15708636,-0.12066605,-0.27512482,-0.62858623,-0.58608514,-0.33187792,0.053868946,0.28779313,0.41730848,0.57359916,-0.30604807,0.045629196,-0.96582794,-0.42486033,0.69057715,-0.39877424,-0.30324155,-0.2777996,-0.13608629,0.051822197,0.45035926,-0.69896346,-0.12864585,-0.34324202,-0.548787,-0.057085738,0.3982277,-0.7576664,0.21704678,-0.19739711,0.7651895,-0.000961821,0.28559142,-0.4713126,-0.5944049,0.72111434,0.09288992,0.59724873,-0.38037562,0.022673236,0.6804756,0.24363837,-0.18559745,-0.7674556,-0.34548682,-0.2096819,-0.9981342,0.003468501,0.16636309,0.20365626,-0.4568033,-0.29284638,-0.1800911,-0.13323477,-0.12400814,0.15730374,0.14331079,0.11285317,0.65361536,-0.7055273,-0.6650299,-0.95113593,0.2686746,0.61094296,-0.32449445,0.07964658,-0.41651607,0.21593075,-0.081836246,0.4636387,0.036016934,-0.01406921,-0.049137764,0.16412199,-0.22642733,0.17803007,0.07207758,0.8664314,-0.4201581,-0.017282736,-0.19929048,-0.41939974,-0.6625546,-0.3679454,-0.5882707,0.030301252,0.032216135,-0.10500305,-0.99832827,-0.13158813,-0.10453914,0.3363224,-0.20038454,-0.08743324,-0.5637298,0.16016042,-0.27735385,-0.67081714,-0.081201516,-0.7388663,-0.7734413,0.7053706,0.5907207,0.69531995,-0.61588424,0.9404895,0.44626385,-0.36907995,0.8268052,-0.21676618,0.22511405,-0.43222994,-0.34342325,0.2473536,-0.43931672,-0.021481507,0.6968336,-0.019957686,0.9993476,-0.33431494,0.12427237,0.6340495,0.6406811,0.14166756,0.7058967,0.8527155,-0.06487893,-0.13282704,0.9980206,-0.27782175,0.5007047,-0.35120916,-0.52038705,0.9979166,-0.9952743,-0.103214785,-0.12208142,-0.15148976,0.2320306,-0.006732794,0.36852378,-0.13210255,-0.89642227,0.90921986,0.1281301,0.43468517,-0.7163845,0.3878447,0.68114376,0.19620183,0.46435523,0.81043357,0.294771,0.6486944,0.51244426,-0.9999393,-0.63401014,-0.27782214,0.7690335,0.001707247,-0.7014911,-0.58732134,-0.6349497,0.7642711,-0.9520785,-0.07385397,0.53485155,-0.04542769,0.05888359,-0.3014355,0.2883454,0.56388223,0.8784768,0.22365859,0.2796802,0.25020337,0.4289579,0.04160616,0.20129311,0.6169197,0.61372787,0.098838374,0.43872622,-0.4874354,-0.4414446,-0.28971148,0.6968032,-0.9953325,0.49408698,-0.19368619,0.2358837,0.18824022,0.27281496,0.27536356,0.99969846,0.046826616,0.44792286,-0.14405504,-0.38274223,-0.15944785,0.12410459,-0.88179296,0.1864025,-0.457627,-0.63266754,-0.58000946,-0.4002585,-0.09102486,-0.20845826,-0.52481925,0.8248519,0.095230974,1,-0.021148892,0.7103257,0.012840931,-0.09647622,-0.7479455,0.033102974,0.39915478,-0.023419831,0.20985532,-0.4882742,0.37910718,0.5022947,-0.044532143,0.47089973,0.34921777,0.22694346,-0.6044024,-0.18659124,-0.08443654,-0.90222317,-0.47124586,-0.6058806,-0.15607907,-0.38665643,-0.8921581,0.39515197,-0.41674998,0.7266208,-0.5056361,-0.36948287,-0.4540827,-0.11043172,0.37263793,-0.44644734,0.2720686,0.08735248,-0.2584082,-0.14315155,-0.11734659,-0.45998505,0.9999999,0.28602195,-0.92223257,0.43778878,0.99966365,-0.6361482,-0.43891445,-0.99991286,0.3450708,-0.1734341,-0.18926394,0.39920965,0.5192355,0.20925179,0.5987932,-0.6508166,-0.20659834,-0.42658374,0.15755756,-0.63257885,0.17207734,-0.11764032,-0.99988514,-0.9986907,-0.97020924,0.13696535,0.05427235,-0.0907759,-0.26805067,-0.14851832,0.36474517,-0.24166854,0.2489875,-0.5836632,-0.62967753,-0.10570632,-0.78479326,0.12993558,0.286491,0.66165596,-0.24139644,-0.8623979,-0.99980336,-0.26910493,0.28569162,-0.28761578,-0.15200897,0.44768208,-0.99225533,-0.54361147,-0.38359272,0.2152753,0.0169279,0.46721065,0.68807507,0.8694828,0.2935854,-0.28570247,0.21149322,0.50378066,-0.2759691,-0.69580966,0.56191033,-0.5937605,-0.24259141,-0.5243072,-0.9109475,0.51386017,-0.18463516,0.42728093,-0.35885066,-0.31453773,-0.053575587,-0.13425912,0.53775966,0.21149255,-0.007007081,0.4252454,-0.27721268,-0.1960253,0.5750126,0.119928904,-0.18984415,0.9997574,0.23979464,0.010000119,0.45518526,-0.21292803,-0.3556121,0.16827975,-0.8150775,-0.40400776,0.48317933,0.22459906,0.48362824,0.6181042],
    [121,1,"CC(C)(C)CC(C)(C)c1ccc(O)cc1",-0.730799,-0.15064222,0.011714327,-0.39435753,0.53627926,-0.44539344,-0.7941736,0.4049641,0.002561377,-0.49590465,-0.78540665,0.16871312,0.18206686,-0.24671395,-0.5451784,-0.55152977,-0.12240997,-0.5692938,0.45861977,-0.47145653,-0.32666337,-0.73537636,0.34352273,-0.28619462,0.1953156,0.70745677,-0.113614306,-0.11191972,0.8998222,-0.09420926,-0.37547433,0.6860772,0.4697774,0.14547963,-0.57153386,0.7504013,0.022292389,0.5840291,0.93714195,-0.86563826,-0.9953665,-0.257989,-0.036519337,0.26566806,0.3775511,-0.98095757,-0.26550522,-0.31090748,0.96622115,-0.27078,0.76155597,0.18489352,-0.384757,0.2385041,-0.96812814,0.61458206,-0.4193349,0.74857485,0.6093357,-0.06812084,0.09142639,-0.4735407,0.17550795,0.5664774,-0.15519339,0.07712356,0.38572913,0.68281,-0.30531734,0.44396996,0.631278,-0.647361,0.05848385,0.4405506,0.8177493,0.047019962,0.54751223,-0.50803006,-0.6427726,-0.99883586,-0.5565641,0.4265672,-0.5043761,-0.5838996,0.21278687,-0.85650253,-0.3629086,-0.5492315,-0.28590125,-0.018072492,0.23039,0.12099954,0.29341722,-0.48534518,0.363749,-0.1728245,0.8013598,-0.036951877,0.5025928,-0.06255762,0.5625576,0.060250398,0.59905255,0.28243005,-0.226252,0.5985472,-0.18559054,0.4496999,-0.94872946,-0.38123286,0.20271757,0.03929947,0.059009627,-0.20703922,0.4218379,0.72769064,0.4137382,0.16783307,0.99851197,0.3187669,0.21914996,-0.34429324,-0.18579586,0.33290163,-0.5829686,0.50351727,0.23612587,0.34902796,-0.6002703,0.9999469,-0.08977767,-0.038288448,0.03184648,-0.31928584,-0.6253575,-0.84925324,0.16103844,0.7705602,-0.80040216,-0.61876833,-0.99886465,0.7470074,0.9954311,0.46936965,-0.18470865,0.18921708,0.23891318,-0.35813922,0.89246434,0.09877959,0.11054469,-0.8387163,0.56472325,0.17347918,-0.472705,0.18662418,0.22701427,0.98759085,-0.834179,-0.39993224,-0.973781,-0.058768068,-0.389725,0.63039887,0.08246091,0.22255489,0.8054443,0.47545958,-0.19396237,-0.4201092,-0.6740448,-0.09801221,0.4877905,-0.21518697,-0.2915622,-0.9907028,-0.6950629,0.47456902,-0.5619692,-0.34720623,-0.036817193,0.6593458,0.3290313,0.32451218,-0.4957288,-0.19063096,0.5748604,0.39805162,-0.48777723,-0.4813303,0.17548096,0.20186892,-0.14580216,0.6680605,0.14942406,-0.47966644,0.11451169,-0.44337657,0.40100622,-0.473964,-0.22922128,0.06907483,0.12119886,-0.5152844,0.35107926,-0.526371,0.26644498,-0.1280323,0.21996108,-0.9975556,-0.13869339,0.35111707,0.59576195,-0.10547261,0.7061319,0.53379416,0.4012326,-0.32541493,-0.37517232,-0.03352869,0.054127827,-0.45547342,-0.30071414,-0.62991387,0.9975197,0.5890473,-0.009662284,0.08224881,0.08292657,-0.37057906,-0.015399304,-0.07117008,0.34376585,-0.07481976,0.24461566,-0.13750659,-0.002388722,-0.5786366,-0.5434751,-0.055428475,0.9237761,0.5387634,0.30194998,-0.353967,-0.38640013,0.253214,-0.009305916,-0.15782751,-0.07864631,0.23907389,-0.13534817,-0.9984042,-0.29137415,0.67324185,0.22903845,-0.5547097,-0.5742301,-0.027925601,0.5043045,-0.5338735,-0.52778345,0.60342723,-0.5416079,-0.5869716,0.49813408,0.17723902,0.6724198,0.3557446,-0.4443019,0.21178702,-0.68979496,0.48609206,-0.06537685,0.28290308,-0.5215884,-0.28881505,0.04720795,-0.29147628,0.14481652,-0.78655255,0.6052973,0.99938947,-0.16717166,0.44954386,-0.003061866,-0.25537238,0.27863434,0.5424521,0.7910543,-0.031922285,0.20664234,0.99784994,0.24091718,0.78432584,-0.054283153,-0.5790988,0.9978565,-0.99692833,0.44540536,0.46801028,-0.13911033,-0.48261133,-0.46293148,-0.23919366,-0.49771735,-0.8941363,0.8738727,0.33075368,0.2925787,-0.10804229,-0.027345315,-0.0957837,-0.16053712,-0.5404551,0.93348086,-0.52232033,-0.20872302,0.0695298,-0.95978135,-0.14205225,0.13918951,-0.16205034,0.7049795,-0.51449347,-0.47850335,0.05477018,0.23468135,-0.9733338,0.27912953,0.18005034,0.074326746,0.024565719,0.07499523,-0.314646,-0.13789865,0.8860928,-0.18351428,0.40808532,-0.3438034,0.078461215,-0.23673601,0.03999115,0.7707729,0.16221449,-0.5289612,0.24272765,-0.72965544,-0.49787354,0.07305268,0.6316119,-0.9921928,0.091070935,-0.45327127,0.1620717,0.3993091,-0.30620405,0.38206652,0.9995591,-0.12058799,-0.609423,0.23316492,0.30431566,-0.84449244,0.10781524,-0.9105276,0.27036333,-0.11239782,-0.11556279,0.30487055,0.23893864,0.61528087,0.25873268,0.41385794,0.8765143,0.6589367,1,0.06224233,-0.52646494,-0.39061743,-0.025212886,-0.812312,-0.2972589,0.23543675,-0.3965143,0.11883156,-0.26201308,0.25769585,0.578219,0.25322112,0.49997413,-0.11106038,0.29018578,-0.265063,0.61715674,0.21183328,-0.86300635,-0.6663823,-0.4168986,0.36901265,-0.34038934,-0.9683328,0.08317476,0.22314839,-0.22029233,-0.18054041,-0.10842281,-0.74812055,-0.6193925,-0.57145405,-0.09742238,0.53542334,0.42735833,-0.42505774,0.1167258,0.07053487,-0.5662373,0.99993736,0.44536892,-0.98952633,-0.39514068,0.9996222,-0.7446286,-0.13095826,-0.9990222,-0.24081556,0.39029178,0.23484549,0.2570374,-0.38886714,0.38820326,0.17088811,-0.7652589,-0.5020438,-0.614432,-0.5521369,-0.43837467,-0.44820565,-0.09629898,-0.9999514,-0.998268,-0.96157306,-0.4360367,-0.3926598,0.20710073,0.24782465,-0.721459,-0.41365117,0.06291115,-0.43761897,-0.3186957,-0.7347365,-0.51686674,-0.06585008,-0.10045306,0.37733305,0.4722712,-0.3300889,-0.80587196,-0.99993217,-0.031948466,-0.3629204,0.06796811,0.46587503,-0.43312338,-0.996984,0.1509843,-0.563719,-0.079040416,0.3146934,0.33385894,0.4025268,0.9433807,-0.54083854,0.24509174,0.53070825,0.41836035,0.13697128,-0.7773532,-0.3286319,-0.060823612,-0.43170178,-0.45239398,-0.4243225,0.18264818,0.2071811,-0.63951313,0.17106047,-0.3908862,-0.18811059,0.53349507,0.07185641,-0.5549532,0.1680485,0.41073924,0.5170003,0.07853294,0.19978812,-0.33652914,0.00884164,0.9998019,0.74402755,0.17789254,0.014774479,0.36166626,0.484877,0.10438776,-0.77014446,-0.33387804,0.39661,0.4965801,0.65508854,-0.61479455],
    [122,0,"CCc1cc(C2=C(C(=O)O)N(c3ccccc3C(F)(F)F)S(=O)(=O)c3ccccc32)cc2c1OCO2",-0.33631903,-0.47790632,0.23975272,0.047468077,-0.45381674,0.22145453,0.10777389,-0.21036763,0.45413962,0.43729162,0.04716171,0.04750127,-0.08466659,0.10723617,0.27070096,-0.4454968,-0.7283584,-0.0282313,-0.44593498,-0.43081102,0.24946035,0.73295957,-0.002383708,0.3937736,0.71453726,-0.27374023,0.5842276,-0.6536167,-0.117395245,-0.119305626,0.12119357,-0.6891539,0.19612017,0.26070693,-0.32993302,-0.051982466,0.38915253,0.6127522,0.99991745,0.09220596,0.19316061,-0.5634767,-0.29398382,-0.10077189,-0.020890193,0.99021375,0.04382708,0.60118824,-0.1433112,0.8213354,-0.5004231,0.8721647,-0.21977612,0.33891165,-0.06770619,-0.08418855,-0.7436273,-0.9929999,-0.06344268,-0.64353895,-0.43466914,-0.10440766,0.21603164,0.41886994,-0.49659103,0.56058985,-0.38121775,-0.3416142,0.04882294,-0.4316876,-0.9056158,-0.22456314,0.46153486,-0.29365057,-0.11867723,-0.5200279,0.47219908,-0.12946087,-0.44074938,-0.9998059,0.24943249,0.56565577,-0.9553158,0.56536824,0.20316274,-0.9264203,0.5641199,0.24968006,0.007661785,-0.16580454,0.28255263,-0.10170954,0.2088666,0.1695412,0.99672556,-0.3026998,0.6337586,-0.013527331,0.19085136,0.31170303,0.40172055,-0.83982223,-0.12002429,0.6297569,-0.99995047,-0.44892308,-0.09828357,-0.06704586,-0.9557753,-0.17577931,-0.49018914,-0.07287342,-0.4437965,-0.8278283,0.42600998,0.77900255,0.28935945,0.06129005,-0.48819992,-0.84785694,-0.02921158,-0.2672709,-0.44422802,-0.5355515,-0.46723413,-0.17247128,-0.33845928,0.5219818,-0.40528965,0.9995734,-0.16088064,-0.003293703,0.060490694,-0.07823705,0.097036876,-0.9891049,0.72668356,0.5203121,-0.42508718,-0.18019412,-1,0.08742943,-0.52307916,0.5002015,0.57313406,-0.42974907,0.41559252,-0.33204475,-0.9999512,0.48658052,-0.60567164,-0.41566074,0.13237822,0.03309081,-0.4544998,-0.18674763,0.53242284,-0.9995059,-0.93622166,-0.5305427,0.9189676,0.6789226,-0.77417755,-0.39332864,-0.21587187,0.59311616,-0.07071382,-0.030175306,0.6402553,0.6352912,-0.74208295,-0.27299848,-0.35597834,0.05515218,-0.23405722,-0.8155238,-0.32245016,0.25819576,-0.61907256,-0.16426721,-0.32472304,-0.9909704,-0.6968188,-0.7899771,0.9347587,-0.124712706,0.122243464,-0.5614527,0.08454291,-0.15133002,0.15750653,0.78547615,0.049230456,-0.5293498,-0.37545282,-0.2387884,0.050189707,-0.5388771,0.23129897,0.13898483,0.033293787,0.4053693,0.16246283,-0.4361467,0.2908638,0.1485678,0.7441958,0.47752485,-0.3813822,-0.9998864,0.59675276,0.21464194,0.46302837,0.43662912,-0.37600875,-0.560785,-0.7031142,-0.028467856,0.562395,-0.049623597,0.7287067,0.0512329,-0.6579429,-0.096434675,0.91743994,-0.57560587,0.4871151,0.40390223,0.2536923,-0.53949773,-0.6241646,0.52173394,0.7955498,0.2840625,-0.2966965,-0.4364368,0.49469706,0.20670253,-0.40762213,-0.571128,0.89028925,-0.71417904,0.4518996,0.040253814,0.43002227,-0.80184186,-0.30997384,-0.80106705,0.3911922,0.17934726,0.1897763,0.7098318,-0.72055304,0.010679858,0.1855832,-0.6450623,-0.1613904,-0.10913641,0.27117857,0.4808788,0.02511855,0.6681984,-0.044596095,0.44245136,0.6636643,0.6654716,-0.7224446,0.26492622,0.9068474,0.58574635,0.11613835,0.9994022,0.12335895,-0.38002247,-0.40021944,-0.18235758,-0.035035416,-0.43026572,-0.9402404,0.5486833,-0.21650572,-0.10817206,-0.79097337,-0.39348614,0.2345518,0.4311377,-0.22082031,0.65239525,-0.25925943,0.42874402,-0.477004,-0.9885025,0.05221624,0.62844056,0.12997803,0.10014557,1,-0.9867764,-0.64748883,-0.41851074,-0.5764057,-0.22361824,0.15697636,0.6624323,-0.33926886,-0.20035997,-0.999873,-0.10148685,0.39373428,-0.83972776,0.3877393,-0.490737,0.27609336,0.20056285,-0.83145714,0.14145617,0.09293632,0.07747947,-0.89677453,-0.27875784,0.27496043,-0.2801782,-0.33592105,-0.76307076,0.17182663,-0.33941835,-0.58214253,-0.775036,-0.35360488,-0.50703233,0.5049477,0.051564187,-0.1762819,-0.5422526,-0.032371204,0.85831904,-0.37537876,0.6668178,0.07950081,0.09529165,0.06672958,0.75777686,0.28973272,-0.45982793,-0.28832144,0.31379628,0.63899046,-0.34837145,0.21001798,-0.9977677,0.918911,0.77308255,0.16512954,0.5357279,0.02117844,-0.14794563,-0.26695842,0.9997809,0.12288088,0.13746442,0.3874382,-0.39636746,-0.5009099,-0.4161233,-0.93767685,0.82636505,-0.05457206,0.28112534,-0.396062,-0.005225403,-0.299472,-0.505329,0.7504978,-0.84040993,0.33659798,-1,-0.6075998,0.19076926,0.52391535,0.836589,0.105668284,-0.6016791,-0.67266893,-0.09373923,-0.45448732,-0.29712486,-0.16722056,0.26286775,-0.36722627,0.11481528,-0.25676972,-0.8823585,-0.6712173,-0.26454148,0.22064985,0.1952038,-0.49245802,-0.7963972,0.7494956,0.31865734,0.9852527,0.21951616,0.33781222,-0.40390736,-0.123972714,-0.061324645,-0.72584534,0.0765967,0.5619432,-0.7112153,-0.36482662,0.45818245,0.59214705,0.55748945,-0.001386243,0.30907312,0.99971575,0.05738309,-0.9628614,-0.47347742,0.9996373,-0.33748677,-0.1987471,-0.9983465,-0.003360836,-0.6654668,0.7338985,-0.1621706,0.2670858,0.08692606,0.4667183,-0.26263094,-0.23971716,-0.17197323,0.18272857,-0.16995412,0.0703295,-0.5156317,-0.9981169,1,0.95987517,0.56247514,0.5026677,-0.42471135,0.4710071,0.32910696,-0.7533678,-0.5427129,-0.7457106,-0.5737263,-0.93138736,0.2922398,-0.6340987,-0.69060296,0.24220644,0.46608555,0.5919798,0.99833673,-0.9234404,-0.024803063,0.26953942,0.64349186,-0.12984633,-0.5307827,0.18930654,0.1532069,-0.29576385,-0.13775504,-0.56192577,-0.015461671,-0.22577547,0.98440796,0.38076675,0.7787516,-0.39098713,-0.33984053,-0.006420728,-0.13360792,0.08865905,0.07660927,-0.451337,-0.46363783,-0.9817865,0.27979773,-0.3243659,-0.34759077,-0.2912303,0.5176617,-0.5244494,0.21309063,0.41301042,0.18557827,-0.51189417,0.99980193,0.33878544,0.81316155,0.32938588,-0.006530789,0.42440188,0.9936021,0.6934096,0.1627043,0.3655218,-0.3053254,-0.20287491,-0.5181501,-0.9978653,-0.74709344,0.7643369,0.1940909,0.50363195,-0.22942065],
    [123,0,"CCC(C)Nc1c([N+](=O)[O-])cc(C(C)(C)C)cc1[N+](=O)[O-]",-0.2820421,0.17630269,-0.13279893,-0.39092705,-0.27395594,-0.73092186,-0.52853143,0.48697463,0.48529786,-0.09727952,-0.74699634,0.6211614,-0.051421948,0.87001914,-0.462219,-0.780369,0.3726552,-0.18831654,0.061647624,0.30885434,0.47217113,0.3406614,0.4092226,0.7582789,-0.07608651,-0.15251309,-0.44389156,0.3251321,-0.006818758,-0.65611273,-0.4311674,0.6034559,-0.52978116,0.6984718,0.13387167,0.40095836,0.24807039,0.42527023,0.99769,-0.3170427,-0.9579061,0.10237543,0.2662737,-0.1210465,-0.58900595,-0.7457228,0.012563912,0.304822,0.8055086,0.7093547,0.5046503,0.3023773,-0.8405895,0.129473,-0.6464202,-0.10723519,-0.67306626,-0.5642726,-0.11208875,0.45190665,0.23828992,0.5190034,0.5610506,-0.28887016,0.44836637,0.63105834,0.7717584,0.24167517,-0.28174132,0.19629411,-0.7735018,-0.85746855,0.48416436,-0.5821615,-0.18110487,-0.6560075,-0.24781722,-0.28937533,0.33515024,-0.99970084,0.87791115,-0.6800033,-0.90370715,-0.15840718,0.27183333,-0.740806,0.07515482,-0.08268293,-0.6390047,0.19054638,-0.6409173,0.30056775,-0.33517453,0.07558301,0.9995732,-0.5226679,0.27032074,-0.43649805,0.2580097,-0.37611616,0.43496484,-0.29313472,0.41137436,-0.74567336,-0.9774226,-0.7801766,0.08174256,-0.040851556,-0.83217037,-0.3030354,0.35724062,0.066678524,-0.51906186,-0.5702928,0.18237385,0.06493192,0.12332367,-0.14282861,0.99737287,-0.31665266,0.47540987,0.044161007,-0.051993545,-0.52856904,-0.55616415,-0.07441281,0.59430665,-0.30876908,0.586482,0.9996876,0.1217326,0.13926786,0.4556604,0.53409535,-0.12648104,-0.9782481,0.64369804,0.5447721,-0.8410403,0.295653,-0.99705833,0.76483315,0.45703593,-0.5628788,-0.5614852,-0.06489372,-0.39463282,-0.2409491,-0.5336134,-0.16098891,-0.33996087,0.6033206,-0.44356936,0.42990142,-0.5567652,-0.37194896,-0.43847433,0.39624542,-0.95756036,0.7129049,-0.8931485,-0.18495706,0.16777578,0.488432,-0.12925236,0.3665204,0.15439336,-0.18430339,-0.14227496,0.608952,-0.45811597,-0.08232025,-0.09018898,0.2731199,0.7151896,-0.77208006,-0.7738103,0.021925695,-0.45187947,0.32463974,0.20363364,-0.997388,-0.8113211,-0.335102,0.41258094,-0.46517035,-0.033988934,-0.26904103,-0.313652,-0.7402299,0.33661145,0.58662325,-0.19323646,0.24728523,-0.6717896,0.24984844,0.70669883,0.9142517,-0.044679414,0.28842145,0.19596247,0.38133517,0.48326045,0.14465019,-0.5443522,-0.71466446,-0.34571424,0.22055766,0.4329771,-0.99912286,-0.47944862,-0.502046,0.18101321,0.023477128,0.6542569,0.5764428,0.5746059,-0.042756796,-0.60733616,-0.8099298,-0.21372245,-0.70047706,-0.31253448,0.48051405,-0.9724435,0.20320794,-0.2777815,0.031800132,0.4301671,-0.7798448,0.39541718,0.5362748,0.5866921,0.0412796,-0.2001458,0.54288167,-0.08397269,0.06968169,-0.36402026,-0.30289826,0.48410875,0.6740098,0.23255572,-0.53998923,0.024012668,-0.5189713,-0.67324996,-0.15416507,-0.32790494,0.39208674,-0.580579,-0.99814373,-0.43297845,0.35191122,0.14432192,-0.5441181,-0.34323347,-0.4655979,-0.07377051,-0.411675,-0.68580383,0.35439518,-0.5033802,0.18285088,0.85614794,0.14010212,0.18170798,0.30119503,0.01328351,0.06896941,0.22637519,0.89063144,0.65709126,-0.12811701,-0.6455595,-0.6857719,-0.46603477,0.22133943,-0.26205426,-0.6359907,0.6645908,0.9968329,0.07180991,-0.64211375,-0.040774684,0.44676802,-0.22014238,0.47821367,-0.30169246,-0.25883302,-0.1834314,0.9430663,0.35719624,0.9783058,0.23779237,-0.3835615,0.9991499,-0.978335,-0.518903,0.004738124,0.7536725,0.8493934,-0.8566257,-0.3573018,-0.43233758,-0.5270061,-0.62117755,0.28507665,-0.15826052,-0.106118456,0.083814025,-0.31376964,0.3393563,-0.3206547,-0.92132676,0.05674657,0.3124159,0.11995991,-0.9852603,0.37133765,-0.082140796,-0.2211042,0.9021506,-0.893514,-0.3423551,-0.70418537,0.4845279,-0.91589963,0.45218208,0.108711876,0.21007831,-0.44005272,-0.44456133,-0.013875717,-0.3831739,0.11630678,-0.037187096,0.7806385,-0.4563756,0.81504667,-0.42334476,0.7671578,-0.6380457,-0.47596,0.40734228,0.1237587,0.6670083,-0.3428221,0.2784378,-0.6486641,-0.9063177,0.028987417,-0.40764928,0.038688812,0.43548816,0.0396117,0.07474981,0.999755,0.29906738,0.14190286,0.44874203,-0.27457985,-0.124804944,0.43642145,-0.7447144,0.29918796,-0.02180385,0.22897902,-0.29554287,0.21894762,-0.56913555,0.063873425,0.6708968,-0.08202752,0.10637527,1,-0.31665224,-0.6419955,-0.5815347,0.32004112,-0.4160173,0.56359726,-0.59414214,-0.50308836,0.6954694,-0.29423404,-0.29080585,-0.3418228,-0.6600462,0.7676661,0.15178843,-0.730145,-0.10993162,-0.5782945,0.38794544,-0.89440405,0.47212514,-0.63624793,0.775803,0.005181013,0.8107545,0.28658485,0.57937133,-0.09398646,0.2251459,-0.2471037,0.25326377,0.9983545,-0.39614362,0.041591134,0.7677534,0.65227187,-0.5969472,0.9203673,0.33096418,0.15272504,0.99996877,-0.10638139,-0.9579987,-0.21831682,0.99976045,-0.73149675,-0.55721784,-0.99930567,-0.26777914,0.23638906,0.85606617,0.37757304,-0.67737836,-0.060474742,-0.1499286,-0.6457387,-0.42119095,-0.14517212,-0.67450243,-0.33087972,0.089655675,0.2951965,-0.999924,-0.99571157,-0.89507926,0.40526125,0.37056112,-0.16484505,-0.53251815,-0.5008999,-0.800574,-0.7484377,-0.20663089,0.23305559,-0.90329534,0.61053514,-0.18608035,0.19659518,0.032195773,0.21411599,0.17335059,0.3333182,-0.9999322,-0.2839716,-0.14226729,-0.28871652,-0.5186476,0.18696843,-0.062118795,0.8589315,0.2652475,-0.77880687,-0.27824906,0.3450451,0.48328024,0.9412317,0.60807925,-0.009414863,0.20987244,-0.1352071,-0.2933034,0.27009878,-0.036022022,0.015939832,-0.35093278,0.21170312,0.32351807,0.16505577,-0.48053354,-0.10259651,-0.44627026,-0.7528575,0.048148338,0.7898343,-0.21507931,-0.021611992,0.18333443,0.9546709,-0.21768492,0.23866306,-0.62296724,0.5209884,-0.7493875,0.9987846,0.037150875,0.15450923,-0.63743955,0.5461093,-0.7330855,-0.209412,-0.97304785,-0.6361507,-0.56713414,0.2688861,0.6362327,0.2579682],
    [124,1,"CCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O",-0.28699154,0.024806531,0.16824546,-0.65986484,-0.69871277,-0.45127365,-0.4953151,0.552237,0.5627001,0.017700523,-0.32123464,0.2859384,-0.028574122,0.41040313,-0.19365531,-0.54805785,-0.04858866,-0.2618174,0.049911845,0.18383415,0.72413874,-0.062222667,0.2935147,0.59573513,0.046951078,0.024349846,0.00620416,-0.28599417,-0.40389702,-0.5911109,-0.024294352,0.27249125,-0.36016515,0.42319193,0.34071115,-0.39986363,0.53837365,0.5036617,0.9814022,-0.20790435,-0.98025477,0.1392601,0.5745929,-0.22830684,-0.58654445,-0.9582275,0.12792194,0.6092256,0.9241072,0.32897425,0.51755774,0.1934825,-0.80346674,0.18795288,-0.7837681,0.06982217,-0.7779785,0.2807962,-0.2381816,0.47220004,0.0543769,-0.13344823,-0.3569483,-0.43404397,-0.001616579,0.5614139,0.35884905,0.18620874,0.21988513,0.01866497,0.36369982,-0.9798375,0.39843562,-0.46117106,-0.4926105,0.39361045,-0.19780545,-0.4146139,0.12656128,-0.99862504,0.26256612,-0.4750009,-0.9499346,-0.07937541,-0.28041875,0.000681814,0.12189955,-0.023176929,-0.7343759,0.10706858,-0.4755404,0.3468472,0.2216094,-0.34363937,0.9991357,-0.7490933,0.50082,-0.22123693,0.14160807,0.18103097,0.6089467,-0.23101246,0.5390886,-0.7647567,-0.7482957,-0.8301266,0.30087993,-0.72814536,-0.902491,-0.092129394,0.31927282,-0.6408977,-0.41519317,-0.42030546,0.23243529,-0.32370916,-0.198567,-0.27378538,0.99944013,-0.74992764,0.39561027,-0.55644447,-0.4169083,-0.40638086,-0.64602786,-0.46750167,0.021860788,0.17797571,0.21718988,0.996334,-0.069611475,0.5055479,-0.59552383,0.46533754,-0.40593767,-0.73311985,0.60057914,0.12629247,-0.8482053,-0.38687408,-0.9977644,0.65514183,0.45277655,0.16080236,-0.24702676,0.12557158,0.2348815,-0.3416634,0.6092794,-0.038095605,-0.07666935,-0.39018875,-0.44776702,0.6329016,-0.44252923,-0.41043139,-0.1963178,0.9492719,-0.90854836,-0.88780886,-0.9794081,0.011109241,-0.13186699,0.021607751,0.42916954,0.6043091,0.2869065,0.45451015,-0.5673283,0.50583476,-0.4812792,-0.092681766,-0.19841492,-0.5177413,0.71533006,-0.85840535,-0.8526846,-0.07223354,-0.336516,0.34104168,0.17326903,-0.9995206,-0.5245519,-0.09942738,0.25284445,-0.2603506,-0.20374253,-0.35079363,-0.7186207,-0.5256929,0.7956513,0.6699733,0.40487295,-0.1339073,-0.5361805,0.002647066,0.3578249,0.97909904,-0.49471924,0.5206991,-0.39638963,0.5608299,0.73323756,0.05270308,-0.5836044,-0.7592137,0.62353534,0.5430442,0.32358253,-0.99662185,0.080299824,-0.1079871,0.2921953,-0.29275185,0.4059373,0.39109883,0.26331836,0.4078473,-0.3426973,-0.6439562,0.03403815,-0.32569557,-0.000801705,0.18762131,0.9863413,0.13545638,-0.56572956,0.2951747,-0.13113433,-0.6195842,0.2684867,0.5579494,0.5248309,-0.19418189,-0.49047375,0.03129369,-0.058941804,-0.3025563,0.21081664,0.013240537,-0.21064068,0.82768875,0.7272586,-0.2971138,0.30940706,-0.3220695,-0.23232034,0.36123508,-0.6166158,-0.27706742,-0.39752108,-0.9988041,-0.49104187,0.21276036,0.09195878,-0.4992039,-0.3365499,-0.24960697,0.6838665,-0.096205205,-0.7468875,0.6170766,-0.44873142,0.17026758,0.75037986,-0.042878874,0.21437722,0.6045833,0.294436,-0.072612785,0.19655946,0.95680076,0.66415983,0.17916563,-0.41449675,-0.5227332,-0.503984,0.22771761,-0.29439536,0.34660083,0.37821364,0.9988812,0.13816063,-0.08709323,-0.11323578,0.4457277,-0.3087529,0.03374005,0.24193902,-0.31271508,0.48720235,0.99519366,0.35686293,0.96436167,0.07669468,-0.22429392,0.9993412,-0.84819186,-0.77385974,0.41398245,0.45159796,0.7226634,-0.7631949,0.3264002,-0.1318706,-0.56419617,0.6285614,0.026020018,-0.36839667,0.28585657,0.5635178,-0.20411639,0.33233574,-0.39410236,-0.9591227,0.35925636,0.52197677,0.0588156,-0.98813784,0.5487382,0.32494614,-0.27216777,0.5951522,-0.84128404,-0.07679334,-0.5732125,0.6607589,-0.79748297,-0.082867265,-0.46985716,0.3149079,-0.32476065,-0.48388824,-0.61593896,-0.38292265,-0.65837836,0.34010905,0.2394268,-0.053639337,0.63343775,0.16790113,0.41659793,-0.6729894,-0.38678145,0.587938,0.19803043,0.32665214,-0.7222142,0.238854,0.30540422,-0.97259593,0.41303793,-0.46993843,-0.31443503,0.3591353,0.12167472,0.38988388,0.99986625,-0.07707802,0.7405593,0.60663354,-0.032232292,0.1685377,-0.19752766,-0.31987497,0.41341308,-0.25279674,0.21369897,-0.33899108,0.40689933,-0.21664375,0.04377785,0.56768197,0.43796214,0.22717187,1,-0.30770823,-0.6322959,-0.55050504,0.25778916,-0.7568689,-0.056217477,-0.615696,-0.69890517,0.64337057,-0.22515225,-0.19616896,-0.5277507,-0.43482193,0.7950988,0.46460745,-0.5183666,-0.15578558,-0.31099308,0.28322965,-0.8965021,0.117711686,0.020648507,0.87590563,0.63414675,0.87206495,-0.5194821,-0.47956192,-0.43313134,0.40986508,0.13421391,0.2081188,0.9976476,-0.031752836,-0.59414864,0.6249513,0.3816757,-0.52044964,0.8017633,0.29356897,0.1302457,0.99996996,-0.016906919,-0.97966444,0.35708684,0.9994286,-0.47964358,-0.3916097,-0.9991028,-0.64963937,0.23852819,0.77626693,0.68455315,-0.49947655,-0.11949936,-0.22718255,-0.0362647,0.14277302,-0.43399516,-0.12000669,-0.21213482,0.33498794,-0.036285184,-0.99996245,-0.9984763,-0.97965056,0.6539736,-0.1296274,0.8110871,-0.030133799,-0.46761188,-0.82455504,-0.70700413,-0.45391846,0.42370155,-0.870069,0.32002193,-0.24928263,-0.3426733,-0.36396834,0.007942224,0.0903873,-0.77890015,-0.9999655,-0.4823285,0.17449024,-0.43075895,-0.36045623,-0.26333195,0.5174014,0.89991593,-0.60040224,-0.6624639,0.2417194,0.32188472,-0.27969608,0.9672559,0.49631473,-0.22830023,0.12675656,-0.01381283,0.08827472,0.067789674,-0.03689431,-0.5267358,-0.020877816,0.8542022,-0.6596607,0.17260711,-0.44750714,-0.4065245,-0.37991366,-0.69996345,-0.03870194,0.7611611,-0.68217534,0.23011698,0.70233566,0.6652761,0.13554223,-0.1769826,-0.75832367,0.6133461,-0.7220449,0.9995473,0.33967337,0.3921527,-0.6792938,0.53563833,-0.5896088,-0.62783223,-0.8937822,-0.60735744,-0.519881,-0.23729298,0.6295484,-0.4888563],
    [125,1,"CNC1CCC(c2ccc(Cl)c(Cl)c2)c2ccc(S(N)(=O)=O)cc21",-0.80651015,0.034785856,0.54478973,-0.004678811,0.15543921,-0.74843854,0.13131908,-0.40608868,-0.29641017,-0.32578686,-0.6178011,-0.10464775,0.040832363,-0.28638196,0.56385756,0.23778144,0.22521807,-0.25587806,-0.38298222,-0.50179154,0.5136443,0.08134947,0.13610344,-0.10875485,0.30634844,-0.5513478,0.22291769,-0.11590644,0.0956914,0.023324693,0.48409465,-0.16344826,-0.06676845,-0.097105235,-0.45291924,-0.54643756,0.018655531,0.49593794,0.99954456,-0.69550335,0.10870173,-0.012481411,0.12295927,-0.1257177,0.48896906,-0.39881337,0.5076653,0.40782204,-0.09552015,0.62492275,0.25484928,0.1943906,0.47719833,-0.15040818,-0.8116793,-0.024310576,-0.56494755,-0.6573872,0.050955556,-0.16533431,-0.31450713,0.02356191,-0.016289705,-0.051730588,0.69191873,0.61784166,0.14944266,0.22841813,0.64456373,-0.24267964,-0.89121294,-0.81717986,0.42315316,-0.37570226,0.46548367,-0.17678717,0.062025584,-0.45106497,-0.30111772,-0.9974067,-0.67761225,-0.39577436,-0.9199103,-0.40452877,-0.3214361,-0.8486237,0.4105051,0.102722906,-0.7202573,-0.43071398,-0.26862532,-0.27828383,0.223502,0.20443723,0.9802512,-0.65975636,0.4555748,-0.15086181,0.5808061,-0.24186532,0.5672847,-0.08586471,0.108825825,0.58256364,-0.99566925,0.03932227,0.57469577,0.030797398,-0.9972504,0.4117205,0.16301891,-0.029925155,-0.4760652,-0.7235705,0.1085639,-0.032011528,-0.6738011,-0.25522992,0.984703,0.22591922,-0.14035715,-0.2733128,-0.18818516,-0.26852918,-0.31091094,0.22444932,-0.2793179,0.33477896,-0.3564923,0.9997284,-0.08674117,0.37577322,0.5069843,-0.15056098,0.08337476,-0.9189973,0.43174008,0.75664026,-0.7817701,-0.042527396,-0.9999866,-0.016364204,0.7908709,0.5864955,0.41963467,0.26655796,-0.121220894,0.46076638,-0.9083064,-0.62690413,-0.18650278,-0.5816142,0.37439615,-0.06771993,0.18634117,-0.3281114,-0.7660654,-0.40549815,-0.5966413,0.8220868,-0.7411808,0.5266208,0.09561651,-0.24830693,0.81286937,0.4240639,-0.17825393,-0.29540002,-0.38714665,0.15804118,-0.31019318,-0.032197133,0.2321292,-0.7167603,0.55777204,-0.8643197,-0.36215773,-0.15845937,-0.07130537,0.045782167,-0.13522638,-0.9537154,-0.17023224,0.13563025,0.4173901,-0.24917391,0.54765445,-0.103685714,-0.4886525,-0.50564015,0.42991775,0.49415436,0.08982849,-0.16956839,0.49360335,0.101939276,-0.47128326,-0.09609779,0.66134447,0.6426508,-0.6477152,-0.25023028,-0.04085891,0.3817992,-0.17791523,0.38515678,-0.028482469,-0.041754812,-0.31672764,-0.99984556,0.43689337,0.4211857,-0.12902558,-0.1986411,-0.08723193,0.066337496,0.093149245,0.134865,0.061446283,0.4388706,0.42988226,-0.16911106,-0.85745895,-0.45395836,0.9814735,0.29734847,-0.41736567,0.4204707,0.25905174,0.11459852,-0.49722525,-0.77421016,0.2934618,-0.0436345,-0.2718944,-0.39386314,-0.26513642,-0.13820286,-0.4861913,-0.107399665,0.8265026,0.36305144,0.8620006,0.64110416,0.36357734,0.39592424,0.35693556,-0.8124109,0.7113036,-0.24943359,-0.20435046,-0.7013655,0.2753031,-0.047902714,-0.525153,-0.029540777,0.48460096,-0.36424863,0.06077826,-0.5553884,-0.6047852,-0.43354082,-0.782257,-0.57087207,0.081628546,-0.41566336,0.50654197,-0.15442465,-0.8322657,0.15557902,-0.1586298,0.9974279,-0.0903439,-0.42447805,0.22640936,-0.46186915,-0.26597175,-0.40444556,-0.04076324,0.27066126,0.543343,0.9955943,0.23066887,-0.06977708,0.6110856,-0.12784342,-0.16836779,0.100436896,-0.9333448,0.50604934,-0.111044295,0.78131604,-0.40479395,0.59059703,-0.042102292,-0.1255864,0.99999774,-0.9910328,-0.30641666,-0.044902936,-0.6592901,-0.7094903,-0.22086307,0.13705048,0.014637877,-0.8692277,-0.9715899,-0.06660106,-0.042355344,0.7919426,0.4713248,0.37636426,0.015095427,-0.7900216,-0.4656256,-0.44029456,0.1958476,0.23974214,0.8976481,0.45757672,0.30906284,-0.2981368,0.09944501,-0.5421559,-0.5962215,-0.04271358,0.340143,-0.895838,0.5648691,0.73870087,0.36928537,0.31165153,0.26653883,-0.277729,-0.2643799,0.6594573,-0.72994417,0.7126928,0.32562774,0.726208,-0.1275573,-0.39755824,-0.13330431,-0.15438707,-0.4685729,0.48963508,-0.5782313,-0.26131353,0.12953508,-0.8510913,-0.9102683,0.36974433,-0.3216451,-0.04856498,-0.044917885,0.52447283,0.24681513,0.9996642,-0.46108153,-0.42575148,0.3427232,0.2297431,-0.20190531,-0.42620566,-0.88799506,-0.78676444,0.55491805,-0.32005107,-0.2689752,-0.23011556,0.048523236,0.6760105,0.3752362,-0.08441483,0.10111274,-0.9980632,-0.17123945,-0.016731128,0.4789577,0.70040125,-0.57312566,-0.38762522,-0.24503475,-0.8953502,-0.37660754,-0.71029323,-0.7261908,-0.32424998,-0.070566095,-0.46056473,-0.07159053,-0.28950366,0.42472303,0.5380748,0.7971687,-0.26921368,0.2242159,-0.46535534,0.7483937,-0.40489972,0.33473173,-0.1875014,0.6029008,-0.02052216,-0.4285057,-0.5561598,-0.38717645,-0.34940127,0.30353323,0.5905504,0.42597914,-0.115876965,0.2373713,-0.005873493,0.37591454,-0.039357938,0.9726173,0.3785592,-0.9590181,0.5541769,0.9998152,-0.6473878,-0.6787586,-0.9800797,0.8192348,-0.05654996,0.7029093,0.5888834,-0.60920334,-0.4453376,-0.43843925,-0.53637636,-0.10866221,-0.14908601,0.09992554,-0.142852,-0.14318246,0.70195806,-0.9999913,1,-0.27084088,0.001270897,0.23218417,-0.49427506,-0.07149449,-0.3567176,-0.45182928,-0.042332496,-0.24143805,0.26635262,-0.80617946,-0.06393201,-0.380596,0.20278013,-0.0610885,-0.084255934,0.5242408,0.86110985,-0.9998395,-0.40308008,-0.23164214,-0.2177966,0.1850242,0.13035019,-0.8397829,0.16868487,0.38788897,0.06463143,-0.028403344,-0.35540122,0.6343695,0.93673784,0.48788175,0.51583844,0.031791102,0.3828959,0.15211396,-0.8500779,-0.1638462,0.34817076,-0.5325304,-0.21599875,-0.7461878,0.66559803,-0.24389327,-0.17033298,-0.106119625,0.25713196,-0.23432364,-0.024920315,-0.3817816,-0.36276683,0.19551624,0.9967635,-0.21644019,0.5099845,-0.40779603,0.21684463,-0.36830688,0.99997365,0.8219396,-0.006166711,0.55556375,0.58549094,0.20330122,-0.054709047,-0.9919333,-0.3406793,0.47807822,0.27162072,0.5420739,-0.14921719],
    [126,1,"Cc1c(C(=O)O)c(O)cc2c(O)c3c(O)c(O)c(C4OC(CO)C(O)C(O)C4=O)c(O)c3c(O)c12",-0.34284988,0.4320292,0.3028581,0.650576,0.72088236,0.20183311,-0.1729722,-0.4838147,-0.45549875,0.72667587,0.11395512,0.14972644,-0.32892242,0.42611378,0.30206782,0.7839383,-0.60619956,-0.78183204,-0.4855209,-0.67199904,0.15683013,0.16624346,0.7864602,0.09601242,-0.048420526,0.26989633,0.02597764,-0.37433702,0.9373304,0.72376734,-0.6381263,-0.07354713,-0.6950532,-0.6391386,0.47429585,-0.90602726,0.10643781,-0.59983075,0.9998677,0.8308553,0.9987086,-0.1709619,-0.29542974,-0.6904028,-0.6889565,0.99326324,0.092690416,-0.2050093,-0.9562975,0.06813462,-0.023271596,0.80703664,0.3563879,0.5835254,0.8329314,0.20445076,-0.43678233,-0.9966794,0.15244581,-0.70763516,0.39164132,-0.3419583,-0.60912293,-0.52708656,0.18612708,-0.6581139,-0.4206453,-0.87026143,0.6162041,0.6337132,-0.9954079,-0.97881305,-0.00888605,-0.7036085,-0.056859825,0.5126012,-0.27642614,-0.2641071,-0.10899762,-0.76302683,-0.9981237,0.07815883,-0.9760374,0.49260932,-0.17881201,0.39437553,-0.20958185,0.38030156,0.67477673,0.42422792,-0.8501072,0.58174956,-0.29718742,0.24853842,0.99984616,-0.18674535,-0.97778964,0.11449483,-0.22913608,-0.72630554,-0.5276079,0.3304554,0.45051304,-0.539144,-0.9999744,0.33425263,-0.42793965,0.5541883,-1,-0.4111849,-0.7363335,-0.55706155,-0.8904082,-0.026421366,0.73085266,0.6578076,0.47109422,0.16991262,-0.6242421,-0.48922357,0.27032614,-0.52946216,-0.54855955,-0.6674051,-0.38157865,0.33448046,-0.7194661,0.48382938,0.09562426,0.6377507,0.45624498,-0.5301503,-0.8004767,0.3016923,-0.33962154,0.9982794,0.7771224,0.9456861,-0.38097098,-0.042222068,-0.99999785,0.62070686,-0.98478085,0.2999535,-0.020536177,0.09695562,0.13035074,0.312977,-0.99999094,-0.09963093,-4.15e-05,-0.67855936,0.54210544,0.050297257,0.14476949,-0.25104597,0.513934,-0.9998662,-0.9460332,0.9296341,0.92816895,0.055101294,0.586702,-0.27832976,-0.105688035,0.1922274,0.073895134,-0.19607724,0.275722,0.63097924,-0.8409358,-0.83469194,-0.30803263,0.41641477,0.45576453,0.6912793,-0.13349648,0.33499444,-0.054251507,-0.45435628,-0.09190522,-0.9998457,-0.67003566,-0.54286706,0.999637,0.19768956,-0.7450779,0.7969307,-0.7019725,0.08259578,0.9966366,0.5295957,-0.009362472,-0.1255588,-0.39302,-0.54206383,-0.07598085,0.99694836,-0.9499805,-0.58467144,-0.6578286,0.96944547,0.08172387,-0.77197534,0.4662257,-0.73351187,0.5630083,0.93987244,0.6000054,-0.99931735,-0.32182637,-0.004426887,0.28290194,0.44995245,0.4600363,-0.8007927,0.61635906,0.7244197,-0.82301867,-0.16445403,0.024138961,-0.54940623,0.56681377,0.85866404,1,0.14312597,0.49485654,0.24599002,0.09712713,0.19728667,-0.30404288,-0.74194515,0.05388187,-0.23458566,-0.62037635,-0.022485295,0.027075099,0.40649545,0.59308606,-0.10395429,0.5855719,0.6854388,-0.12671566,-0.43235946,-0.6432874,-0.3683263,0.22356656,0.63238496,0.5681587,-0.8099223,-0.8358801,-0.43080094,-0.061710212,0.5299942,-0.57214123,-0.85973525,-0.20156859,-0.55777264,0.13149302,0.73088205,-0.7493788,0.106551945,0.6932338,0.12726648,0.14764406,-0.519345,-0.4484512,-0.598611,-0.99912757,0.6463362,0.5025726,0.99985206,0.8380208,-0.22206002,0.708256,0.6751293,0.5772172,0.9392098,0.6021682,-0.29940638,0.80192137,-0.8790586,-0.5506734,-0.7202852,-0.65511096,-0.7997235,-0.8127639,-0.9988622,-0.99998224,-0.082731165,-0.50618327,-0.99460375,0.03674004,0.82675654,-0.77945393,0.37671793,0.99999905,0.8915017,-0.37660122,-0.13341007,0.8082356,0.04489205,-0.5936242,0.51816964,0.20574525,-0.97309697,-0.99986124,0.13967611,-0.15776119,-0.10158793,0.4365748,-0.4553521,0.6684761,-0.374368,-0.9831521,-0.4746718,-0.100031525,-0.54489714,1,0.41262287,-0.14624564,0.8565132,0.1695695,0.45801488,-0.89845854,-0.33700117,-0.7755435,0.9681351,0.028744936,-0.56997085,0.476833,-0.7426927,0.1318628,0.58428425,-0.40594938,-0.97930837,0.4872787,-0.26140144,-0.008992135,-0.24869433,-0.73996943,0.2952004,-0.36691076,-0.9221,0.112273864,-0.35155675,-0.3577926,-0.35443625,0.77420425,-0.9973846,0.9954304,-0.036020376,0.5025364,-0.16571653,-0.050028503,0.4213026,-0.23835638,0.9956218,0.14488712,0.98423046,-0.41668195,0.5357624,0.76936114,-0.70069045,-0.3106299,-0.574053,-0.18339713,0.9826351,0.4358365,0.3225774,0.8122035,0.7023975,0.86079174,-0.97362447,-0.16674992,-0.99999785,0.9076939,-0.31848344,0.05264148,-0.76376927,0.2576258,-0.365957,-0.89585847,0.3739442,0.5631296,-0.5744742,-0.08389435,-0.12330875,-0.46694458,0.87140983,0.842981,0.36600715,-0.68053305,0.6959846,-0.4415452,-0.44604406,-0.7633086,0.8561739,0.4601387,0.96459854,0.99988973,-0.47283202,-0.83832663,-0.19029954,0.5584837,0.8588793,0.893836,-0.81555855,-0.35665095,0.479293,-0.8891352,0.30755863,-0.5438452,-0.29762942,0.8253167,-0.28606507,-1,0.014095907,-0.9865545,0.014234485,0.9937881,-0.66883594,-0.6022529,0.99399,-0.8600859,0.77364624,0.22768918,-0.4126788,-0.24492246,-0.6991348,0.3148692,-0.6470026,-0.08400872,-0.13238558,-0.3095054,-0.121576525,0.0765953,0.6984446,-0.97343683,1,0.952272,-0.6276703,0.7463485,0.9646399,0.2209125,-0.8418519,-0.3453452,-0.4962753,-0.20184852,0.5433162,-0.66502726,-0.083812825,0.09537057,-0.53535146,0.3741627,-0.87400764,-0.5722274,0.99742514,-0.71589786,-0.8986488,-0.710321,-0.4540282,0.4855483,-0.37571284,0.99950635,0.8999989,-0.9003439,-0.40869442,0.25548393,-0.7085946,-0.70509195,0.9610184,0.000641022,-0.95805913,-0.4516371,0.018241491,-0.7154786,-0.93349296,0.50972825,0.8277464,-0.24419795,0.9761582,-0.9997818,-0.1325215,-0.9555486,0.007764177,0.3083492,0.37685224,-0.1303936,0.8474114,-0.37912536,0.57797205,-0.26243687,0.99973834,0.27803957,-0.6287334,0.74067813,0.71695733,0.3442233,0.99898,-0.66612107,-0.6716865,-0.5899422,0.39565095,0.05924423,-0.5823499,-0.9996102,-0.74033314,0.069876656,-0.29005316,0.058526963,-0.81650406],
    [127,1,"COC(=O)N(OC)c1ccccc1COc1ccn(-c2ccc(Cl)cc2)n1",0.28887346,0.013025189,-0.009040917,0.56109434,-0.23963311,-0.6658569,-0.634098,0.5329857,-0.8459851,0.079872385,0.65601814,-0.42711717,0.10272758,-0.7575647,-0.097363,0.3555029,-0.34545442,-0.21498047,-0.24753049,0.41878226,0.5979163,0.1865144,0.066550225,0.124364264,-0.07507564,0.35790995,0.4722451,0.70807654,-0.5783722,0.59017,0.39465377,-0.6348402,0.29771286,-0.13783315,-0.08705044,-0.60097516,0.60817933,-0.05247294,0.9994342,-0.5515183,-0.5965754,-0.025360523,-0.6124739,0.06790431,-0.5417315,0.42121908,-0.38355076,-0.6094074,0.8862506,0.5917642,0.7865423,-0.0672621,-0.058268994,0.42255008,0.17094481,0.14732483,-0.2969696,-0.714416,-0.563796,-0.12857327,0.08966505,0.48321107,-0.55132943,-0.4880218,-0.6656814,0.50619984,-0.44586655,-0.37259316,-0.25146133,-0.23191419,-0.817823,-0.8954877,-0.41363427,-0.7248373,0.47573206,0.11344884,-0.91194856,-0.3105296,-0.34118444,-0.99953943,0.47363734,-0.6716071,-0.92458326,-0.15117063,0.25732937,-0.8516324,0.003721457,0.5225353,-0.4477167,-0.054114234,0.22583203,0.7865431,0.15718165,0.5944687,0.9985263,-0.5380594,0.23061915,-0.114960104,-0.31120926,-0.19919986,-0.049622037,-0.39979726,-0.5121018,0.9748923,-0.9983574,-0.91519123,0.45016795,-0.28935245,0.9411209,-0.02792281,0.35472882,-0.36484957,-0.018577306,0.17821197,-0.10333381,-0.053480156,-0.115724355,0.61728495,0.9489904,0.04445635,0.035741877,0.003994555,-0.16855763,-0.42684764,-0.21836948,-0.17008579,0.27420458,-0.35725763,-0.083201826,0.9991185,-0.4060067,0.1149148,0.059505418,0.38089523,-0.28513986,-0.9846925,0.16370663,0.08596846,0.2410568,-0.6671247,-0.99999356,-0.6474412,0.3643393,-0.10363411,0.36750203,0.10092681,-0.009045101,-0.29058194,-0.99072134,-0.54289037,-0.06374372,-0.4387759,0.5319768,0.015493672,-0.65468025,0.19361454,0.30446404,-0.68415356,-0.35058597,-0.9561261,-0.4175173,-0.6094975,-0.33110997,0.010583358,-0.43535945,-0.19776623,-0.74782443,-0.037024744,-0.3499123,0.30968186,0.5709517,0.5548131,-0.19065614,0.62750375,-0.090067655,-0.62569016,-0.79246014,0.1776781,-0.5644063,0.07730985,0.5449584,-0.8435268,-0.019201804,0.24663551,0.75065017,0.316017,0.2832553,0.5877314,0.42698732,0.122308336,-0.16091044,-0.3058087,-0.028115412,0.22027521,-0.14436892,-0.3089688,0.23717016,-0.74560857,0.16104831,0.04580479,-0.17073302,-0.2016406,-0.018673377,-0.55004007,0.6015278,0.3615544,0.13021299,-0.64193195,0.62431735,-0.9999294,0.41280845,0.24283724,-0.6080727,0.24621594,-0.06156168,0.4278078,-0.13679445,-0.09222994,0.3295451,-0.19793376,-0.016056696,-0.0452842,0.37878495,-0.5457901,-0.96134716,-0.4869806,0.23735242,-0.13616256,-0.1602449,0.64501655,0.02370697,0.10454884,-0.7318026,-0.41553366,0.49374542,0.25128412,-0.6585187,-0.11733265,-0.12216608,0.21284637,0.86983734,0.46899632,-0.016911414,0.25853947,0.60038584,0.42640445,0.34888992,0.47219405,0.17318402,-0.39713514,0.58011615,-0.70685035,-0.087321974,0.37696418,0.59739745,0.41909298,-0.7904609,0.5839333,-0.45079678,0.32451177,-0.052197743,-0.6995314,0.23173052,0.38156024,-0.54475826,0.6320506,-0.26677614,0.657715,0.90405476,-0.7551854,0.49566525,0.99956405,0.17043427,0.49854982,0.5507029,-0.7566197,0.38407904,-0.12708035,-0.63075036,0.2512122,0.5036601,0.9869154,0.08957094,-0.16173784,-0.74487394,0.33152393,0.07521118,0.9032918,0.8455229,-0.68491703,0.3764876,0.6072446,0.6691885,-0.25366688,-0.27529532,-0.021898352,0.99999845,-0.96042997,0.028874522,0.37094402,-0.057711568,0.5736029,-0.5605584,-0.69560057,0.76366514,0.49332127,-0.9917223,0.2765837,0.8082583,0.84889275,-0.26509446,0.026681311,-0.33382824,-0.24970534,0.41063878,-0.5552487,-0.3576068,-0.52044064,-0.9997675,0.4712148,-0.03395127,-0.35064968,0.2776019,-0.79348993,0.75161254,0.63113475,-0.23645109,-0.5029889,-0.40795454,0.0729395,-0.60536855,0.043813277,-0.38035843,0.52094656,-0.08907078,0.12303665,0.092604354,0.1742824,-0.35687307,0.36813343,0.50998706,0.08592111,0.07929599,0.6353187,0.32158577,-0.4004885,-0.6169829,0.25895217,0.29132217,-0.93501025,-0.75540215,0.52879196,0.07799926,0.002093327,0.29155746,-0.032631166,-0.12515837,0.99929243,0.17412363,-0.05101507,-0.12184866,-0.31086835,-0.18495983,0.089696854,-0.7084375,-0.6312385,0.04561626,-0.7682907,0.04772068,0.45272413,0.48883688,-0.002691842,0.28881672,-0.6614964,-0.029441098,-0.9906242,-0.3625681,-0.09003153,0.5405521,0.09168887,0.38630548,-0.48745853,0.36632594,0.1846804,0.31354094,-0.48009843,0.12434467,-0.38574007,-0.12086121,0.5682295,0.116463706,0.23703495,0.41768673,-0.15380256,-0.016192505,-0.38832623,-0.09396365,-0.100618556,-0.3563251,-0.24031664,0.9271866,0.15857658,0.42191014,-0.3393663,-0.29069015,-0.097414516,-0.6669828,-0.15220444,-0.07551432,-0.22544685,-0.5295521,0.26754272,0.4210091,0.26923946,-0.242201,0.4434798,0.99999917,-0.63388634,-0.9354667,-0.05659229,0.9915019,0.26657933,-0.3340228,-0.99992186,0.057062358,-0.9498265,-0.05444666,-0.72590023,-0.5687297,-0.58746326,0.14881113,-0.018717825,-0.38505885,-0.047652114,-0.041643295,0.099593915,-0.26999795,-0.16604638,-0.9999289,0.9999993,0.39081073,-0.4161335,-0.2577728,-0.47924846,0.081587404,0.17347224,0.12843148,-0.18270816,0.28762275,0.62646365,-0.50278753,-0.44819543,0.79118556,0.47350162,0.2565123,-0.43707648,-0.41810697,0.88583416,-0.99922484,-0.09902976,-0.30593553,-0.24101828,-0.045671895,-0.76923364,-0.6294095,0.41241172,-0.07749389,-0.005642414,-0.2572403,-0.4473558,0.17380536,0.9916662,-0.069463044,0.4603451,0.5341389,-0.097950704,-0.29922184,-0.10855268,0.17371406,-0.6584914,-0.48370862,0.01716809,-0.97501963,0.0668247,0.034095787,0.30562678,-0.038861733,-0.6966563,-0.34342158,0.6079863,-0.02158713,0.50658333,0.051009078,0.9991304,0.56996757,-0.5017981,-0.4840467,-0.14252104,-0.25932285,0.99993575,0.6287585,0.6286751,0.17956293,0.5873189,-0.272314,0.17901774,-0.9980314,0.46251857,0.43198386,-0.29979187,-0.47002256,0.46516737],
    [128,0,"CCOc1ccc2[nH]cc(C(=O)NCc3ccccc3)c(=O)c2n1",-0.4678437,-0.24718419,0.39511102,0.30539435,-0.22142695,-0.25959924,-0.114531755,-0.17330357,0.7334266,0.14709963,-0.20001996,-0.3155465,-0.15902767,-0.5032766,0.85368687,0.5290376,-0.29119644,-0.1681486,-0.16577932,-0.14683902,0.4510419,-0.45440388,0.3045148,0.22073488,0.13445587,0.15097722,0.6065967,0.29816034,0.031933304,-0.670765,0.18033424,-0.49798334,-0.13922307,-0.7056848,-0.15959479,-0.20170303,-0.102486946,-0.3184804,0.9978397,-0.31306803,-0.78512466,0.23160435,0.1649487,-0.48295334,-0.16310033,-0.57333136,0.5970476,0.23826335,0.10346816,0.35641578,-0.03096933,0.16445686,0.8075485,-0.000815205,0.13997096,-0.48857722,0.07190402,-0.42679605,0.14215444,-0.62500364,0.11267137,-0.5435422,0.6220791,0.6476447,0.2511676,-0.72838014,0.19518793,-0.55318844,0.30668944,-0.024870323,-0.94858503,-0.99441665,0.6474748,-0.7585321,0.39167374,-0.11441693,-0.6328742,0.41965276,0.729804,-0.99979866,-0.4193037,-0.56264126,-0.8643788,-0.14544967,0.045448836,-0.40807298,0.21095422,0.31582963,0.028250143,0.38938937,-0.021614717,-0.2443061,-0.29578158,0.24661772,0.99937123,-0.06650039,-0.3582983,0.7718096,-0.62084323,0.29930058,0.33343166,-0.14440829,-0.33189943,0.9339473,-0.9850794,-0.8514454,0.16585714,-0.43607485,-0.99979174,-0.50494975,0.070135534,0.26231846,-0.084214225,0.42957252,-0.77791137,0.5273688,0.41250697,-0.3195732,0.9892401,0.086027056,0.19523698,-0.37081954,-0.089700796,0.5721621,-0.065537184,-0.0354567,-0.35598156,-0.7337098,0.2651218,0.9970289,0.48911506,0.40660316,-0.08165212,-0.5418651,0.5466035,-0.9849903,0.62555295,0.5023408,-0.6964305,0.32009858,-0.99998206,-0.4358488,0.42523757,-0.06389425,0.1090177,0.83862686,-0.3913576,-0.2717912,-0.8758517,0.3782139,0.1906367,0.7845899,-0.38812307,0.344239,0.19425705,0.47241512,-0.35890943,0.25158557,-0.3808523,0.80691963,-0.8461582,0.4191796,0.15904579,0.20088388,-0.5246742,0.10805242,-0.7400409,0.4028521,-0.013040248,0.23306088,-0.153277,-0.3953641,0.22277462,-0.40699857,0.1303383,-0.064149514,-0.29439932,0.46115035,-0.040363383,0.45665544,0.8303006,-0.9791397,0.5562137,0.18921968,-0.39746174,-0.38304195,0.24233128,-0.108615,-0.052640926,0.41494343,0.34347337,0.24742803,0.33404976,0.6962182,-0.5238534,0.06807831,-0.63864326,-0.4229753,0.4208623,0.24142627,-0.041101653,-0.0036109,0.353229,-0.025033923,-0.27325314,0.014128876,0.40350598,-0.04613484,-0.12972295,-0.9995042,-0.78001964,-0.38017046,-0.51993513,-0.4256185,0.12726179,0.27496147,0.49378508,0.32812122,0.37494457,0.12246319,0.13337457,-0.39778313,0.19638851,-0.5565495,-0.97674125,-0.005129922,0.23137099,0.2005939,-0.025859741,0.41460752,-0.11026778,-0.3761724,0.02649862,-0.23477192,0.001420534,-0.70182854,-0.04782604,-0.25199422,-0.52632356,0.40958083,-0.97425413,-0.26164392,0.38018793,-0.23697798,0.32839748,0.46806577,-0.61041635,0.53641707,-0.51323384,0.24677901,0.5413804,-0.7604397,-0.19453995,-0.2455159,0.5889,-0.1380149,0.049735855,-0.3230411,0.12843093,0.39290598,0.2573707,0.30734774,0.12857403,-0.01059904,0.35941672,0.11117516,-0.7277169,0.2603832,0.5906667,-0.06058134,-0.61242735,0.95715773,0.387034,-0.25917736,-0.504411,-0.6595419,0.725426,0.7584775,0.1528082,0.6396524,-0.2947276,0.99798036,0.27141038,-0.45659113,0.037976827,-0.33832404,0.17730236,-0.72422373,-0.97610426,-0.11176138,0.57542336,0.9289258,-0.050750248,0.1798074,-0.09158613,0.4051916,0.9999962,-0.91179127,-0.34884655,-0.07517472,-0.031010313,0.32507378,-0.6703646,-0.008345983,0.5429526,-0.52614397,-0.9341157,0.40724388,0.7179122,0.18723126,0.010304566,0.23925753,0.016810836,0.10650793,-0.41883564,-0.5248239,0.11596124,0.28423277,0.94618315,-0.87357444,-0.13216265,-0.24218126,0.2967233,-0.34677076,-0.4922442,-0.4346143,0.48821622,-0.7368521,-0.5618692,0.36342624,-0.029331861,-0.23719679,0.40110123,-0.89810145,0.6000895,-0.6952087,-0.30586755,-0.27918306,-0.38034198,-0.19105433,0.37204367,0.064164296,-0.26072958,0.09931293,0.114796914,0.3306199,0.17135228,0.07050882,-0.19641106,-0.7473154,-0.9488102,0.62690383,-0.034375314,0.2987481,0.2864445,-0.09341379,0.4425826,0.99825513,-0.27610308,0.11917777,0.3845888,0.18710808,-0.29039842,-0.25098813,-0.61540467,-0.49680966,-0.41471568,-0.092477456,0.23391142,0.3169039,-0.74619466,-0.32730764,0.04873523,-0.2949696,0.16732214,-0.9846211,0.544928,0.6385397,-0.43161324,-0.1638123,-0.30786133,0.14685175,-0.09713197,0.023232514,-0.029784381,0.07171301,-0.048801925,0.25681984,0.22575478,0.5730087,0.5926607,-0.6677505,-0.26093018,0.34197995,0.18816264,-0.008243712,0.661905,-0.19707496,-0.42198598,0.27964485,0.8778861,0.32207882,-0.18503252,0.084752075,-0.12374361,-0.76176894,-0.19987273,-0.49504042,-0.12787998,-0.4741441,0.02710197,-0.358293,-0.41535765,-0.22447073,-0.2169264,-0.08532087,0.9611394,0.23745026,-0.93868184,-0.13307069,0.9996471,0.1919359,-0.513403,-0.97919714,-0.3384742,-0.52470523,0.05537898,0.7316449,0.47808665,0.7505626,0.36436144,0.24352455,0.44000366,0.28093904,-0.40835214,-0.3774502,0.13990603,-0.26697,-0.99998647,0.9999995,-0.20835494,0.18584733,-0.6970458,-0.25989208,-0.2872035,0.31550246,-0.7753628,-0.44065163,-0.48417333,0.2636529,-0.56926966,0.061338443,-0.13162637,0.34770516,0.6260018,-0.24347325,0.08062772,0.45680627,-0.99985695,-0.23166801,-0.09292297,-0.33200607,-0.09148657,-0.1672908,-0.21811025,0.2526211,0.5915462,0.64605814,-0.5835966,0.5563203,0.13270725,0.97938704,0.5179598,0.74203604,-0.4926147,-0.21562731,-0.42918754,-0.4878292,0.22198008,0.2762152,0.24695288,0.1807909,-0.12677929,-0.17788556,-0.29023287,0.4373769,0.21645792,-0.22480412,0.28194126,0.7554429,0.31324497,-0.6487339,0.033758026,0.9958086,0.5672745,0.09335853,0.5627918,0.5615498,0.1639239,0.9999724,0.091810286,-0.18297954,0.47029853,-0.015847452,0.030194545,-0.74615383,-0.99366665,-0.50533676,-0.5256791,-0.53779876,0.45985398,-0.33404887],
    [129,1,"Cc1c(C)c2c(c(C)c1O)CCC(C)(COc1ccc(Cc3sc(=O)[nH]c3O)cc1)O2",0.104905315,0.26435077,0.7424168,-0.4270768,-0.20077255,-0.056374323,-0.3946315,0.004710399,-0.102335766,0.8132114,-0.15803602,0.28079012,0.7080474,-0.44153497,-0.6028275,-0.47452006,-0.07851964,-0.73108613,0.31080264,-0.8434398,-0.10008185,-0.016902907,-0.38438946,-0.47114938,0.78132045,0.2035179,0.087352894,0.08831735,0.09619951,0.1100983,-0.41509652,0.26233628,0.4446327,-0.17291096,0.13661684,0.46544567,0.14808382,-0.31600493,0.9996811,0.060362082,0.4374939,0.34966764,0.108244665,0.27451184,0.460964,0.9499688,-0.45452407,-0.8162342,0.5585452,-0.31404224,0.7568924,0.11534854,0.50988257,0.6641576,0.2605728,-0.2158517,0.07119482,-0.9425759,0.2515549,-0.17686325,-0.20302948,-0.64886004,-0.8418235,0.78561187,-0.26908487,0.15342654,0.8587129,0.26688084,0.15795344,0.3665285,-0.93482697,-0.63953793,-0.77371645,-0.23724376,0.5276347,0.4516949,0.6442763,-0.8517666,0.40126708,-0.9987371,-0.9406076,-0.446899,-0.97006786,0.14975847,-0.051857695,-0.96695334,-0.6344605,-0.8312835,0.01893972,-0.45683247,0.29543766,0.019236907,-0.14410673,0.02897525,0.997806,-0.2835732,0.3511315,0.4060556,0.00667492,0.39465398,0.34587517,0.15007664,0.3903032,0.9900274,-0.99983644,-0.7413889,0.27022684,-0.31101516,-0.99999344,-0.28518975,0.22299477,0.067605875,0.36239603,0.12931621,0.6845278,0.92237103,0.3413712,0.4419555,0.23729584,0.6596865,0.3017278,-0.13009007,0.19180581,0.13363427,-0.22273585,-0.6858543,0.14617369,-0.40517366,0.5342267,0.99962085,-0.7366753,0.4700008,0.21418211,0.8070758,0.09445118,-0.9034675,0.11405016,0.77132237,-0.26243407,-0.44532755,-0.9999996,0.22825737,-0.020230914,-0.22242978,-0.7091526,0.8336291,0.3586893,0.68870467,-0.99964035,-0.24345414,0.7694887,-0.7148956,0.40341747,-0.03013831,0.5144323,-0.41539443,-0.12046671,-0.99317974,-0.7504887,-0.07821424,0.5736268,-0.8007956,0.5218693,0.45128688,0.7546936,-0.21494547,0.36336684,0.06093152,0.5309966,0.34771985,-0.5822258,-0.011587806,0.01260732,0.047279995,-0.4156032,-0.4877113,-0.17153,-0.059163466,-0.11784123,0.13375364,0.088981114,-0.84097403,0.12497604,0.64609545,0.9740133,0.58250266,0.5958354,0.7716616,0.03474216,0.012898234,-0.086466506,-0.48621255,-0.05463788,-0.025323648,-0.3489547,-0.7387758,-0.092316076,0.05823538,-0.8197051,-0.59261805,0.010004059,0.12914126,-0.20064363,-0.53538316,0.6768438,-0.066306904,-0.2748652,-0.66215795,-0.58005774,-0.9998633,-0.45509672,0.77019066,-0.16357484,0.31462905,0.76792467,-0.593715,0.2779351,0.28492197,-0.80183464,0.12569167,-0.060456775,-0.5786187,0.55349535,-0.010809089,0.99995774,-0.26121128,0.22767772,-0.15611982,0.31626958,-0.004721981,0.49535412,0.12176291,-0.46528485,0.2973047,0.09059163,-0.42981648,-0.09884061,0.11472309,-0.78285766,0.5649587,-0.9105463,-0.04864752,0.000298844,0.021743802,-0.06352676,0.26278165,0.858357,-0.30838475,-0.6637142,0.14475581,0.29248616,-0.06851578,-0.59812003,0.5422687,-0.001093,0.5826681,0.14283009,-0.2194014,0.0852341,0.3527831,-0.13912097,0.64169437,-0.49817228,-0.05811718,-0.17564058,-0.011718952,0.6463176,0.42569467,-0.4625672,0.17509468,-0.4949022,0.999933,-0.12534632,-0.021976804,-0.37662664,-0.2216841,-0.21817777,-0.076579526,0.59794587,-0.7839219,0.44012043,0.8142128,0.06919803,0.8149403,-0.36118284,0.008241075,-0.38142037,-0.08966103,-0.99000984,-0.10927038,-0.59539604,-0.8421328,0.7136064,-0.6547027,-0.41800082,0.5197069,0.9999999,-0.97268087,0.6872081,0.6935562,-0.019286036,-0.6913709,-0.41568106,-0.042133477,0.1287042,-0.94044876,-0.9996119,0.48679924,0.68700546,0.47947618,0.11788174,-0.106466286,0.33397603,-0.24607597,0.17722706,0.012955634,0.71005046,0.28792915,0.9998567,0.39437938,0.003909441,-0.38793135,-0.28686365,-0.3369176,0.036772367,0.62396973,-0.5179213,-0.14077045,-0.8657495,-0.28388372,0.5342758,0.15282758,-0.16683683,0.36476332,-0.7116691,0.7171024,0.67217284,0.44043654,-0.29204395,-0.7150706,-0.065820046,-0.73566633,0.55768746,-0.70619273,-0.5771323,0.3558759,-0.4548053,-0.48205543,0.7596193,-0.99111634,0.29048097,-0.40987426,-0.15296897,-0.052529495,-0.32708523,0.50187814,-0.07442555,0.9987287,-0.7493711,-0.013160511,-0.15054145,0.18077718,-0.15419862,-0.7196004,-0.8638531,-0.33557642,-0.084548436,0.43457907,0.673818,0.555481,0.28753877,0.71711415,0.0892863,-0.85875005,0.2858875,-0.9999998,0.4196836,-0.83496505,0.13701251,-0.39942622,0.10611933,-0.80424666,0.33428055,-0.1491174,-0.033148196,-0.7015332,-0.4320908,-0.5053375,-0.24337919,-0.39988342,-0.06316876,-0.4200363,-0.41932192,0.1021454,0.07090329,0.39956796,-0.053599656,0.51654583,-0.78177685,-0.26403534,0.9453468,0.5700709,-0.67956305,0.004816123,-0.40751532,0.1204422,0.53451234,-0.8309378,0.14904605,0.100335844,-0.50067586,-0.14948158,0.025729153,-0.62645084,-0.16755152,-0.41147354,-0.923956,0.42605048,-0.99215704,-0.41637155,0.99879134,0.31601372,0.33428025,-0.96260595,-0.40350655,-0.8685293,-0.6950461,-0.39877817,-0.3143832,-0.1667129,-0.20585516,-0.73744106,-0.32103875,-0.68385446,0.13366818,-0.13820498,0.7541751,-0.29341367,-0.99946594,1,0.9396304,-0.5447632,0.026681855,0.7129296,0.40545127,-0.7010997,0.7191961,-0.01161563,-0.52218354,-0.65003175,-0.6524221,-0.24969275,-0.13317686,0.62687075,0.34517652,-0.11755099,-0.48638007,0.9857808,-0.99121493,-0.42522758,-0.6541918,-0.10855555,0.6490974,-0.68794227,-0.3670172,0.79257464,-0.66611105,-0.21860437,-0.5992684,0.4312832,-0.8085421,0.98945326,0.5614492,-0.10094245,0.13216288,0.43826166,-0.22330351,-0.653538,0.36861566,-0.61809313,0.007500982,0.21462637,-0.9876325,0.33612722,-0.7328714,0.35446942,0.018813156,-0.30870795,0.48234615,0.07941879,0.16160284,0.22330311,-0.095929794,0.9996662,0.3901823,0.15925775,0.3140582,0.080633156,-0.34511015,0.9999738,0.42375046,-0.0774514,-0.15772332,0.3444416,0.83897233,-0.06443351,-0.9994842,-0.26228464,0.69893813,0.003351644,0.05579592,-0.8127103],
    [130,1,"C=CCCCCCCCCC(=O)O",-0.6705045,-0.13037252,-0.7886358,0.45721662,-0.092647366,0.16700768,0.18929465,0.12394657,0.44895446,0.38925177,-0.1934792,0.1558836,0.18379177,-0.45056665,0.22021161,0.51393265,0.5651029,0.17752843,0.023137866,-0.07482427,0.4743318,-0.765,-0.26264983,0.19490607,0.5678015,0.4856,0.23305774,-0.20723382,-0.07097903,0.022715934,0.14419833,0.7833385,0.64674443,0.038491804,0.13216084,-0.56865066,-0.19169776,0.69145656,0.04157165,-0.7351677,-0.9879552,-0.1419959,-0.16858703,-0.31739268,-0.12606433,-0.99090946,0.16587813,-0.13594215,0.96174836,-0.11464196,0.6298285,0.6119299,0.28083247,-0.4112744,-0.8947046,-0.29097947,0.92032725,0.97425723,0.16565306,-0.095118806,-0.5439034,-0.24191624,0.019340083,0.6215167,0.55299914,-0.2663921,-0.34606767,0.044317137,0.45033976,-0.5602492,0.6107081,-0.8551546,-0.16210814,0.81818986,0.58727306,0.78871125,-0.04189607,-0.017494176,0.069940455,-0.99990433,-0.27525532,-0.031960674,-0.54812944,-0.24618955,0.51089346,-0.13314277,0.0434266,0.5556744,-0.22007309,-0.45442945,-0.40697056,-0.070972174,0.07446639,0.12410161,0.9759112,-0.33626977,0.5877432,-0.2870779,-0.056609295,-0.40062323,0.5256352,0.2041614,0.32061967,0.56828666,0.89400464,0.5689336,0.37628612,0.15915242,-0.8279938,0.26861328,0.2976641,-0.2862545,0.5995542,-0.16010743,0.13466986,0.25903377,0.24032485,0.26688775,0.9970236,0.6201186,0.009694745,-0.060532484,-0.043534428,0.27991572,-0.6076041,0.25513545,0.13567595,0.64458156,0.49418554,0.9998848,-0.15807894,0.1030392,0.27681187,-0.18796936,-0.03230936,-0.6822966,-0.19824143,-0.019948043,-0.07976076,0.24720012,0.9994241,-0.29370987,0.9775738,0.57549846,0.11444366,0.6002155,0.32436484,-0.025035009,0.98527205,0.42027006,-0.34460106,-0.8588572,0.687114,0.35084748,-0.4248651,-0.02599628,-0.25816292,0.99765223,0.054790363,-0.8397125,-0.9839925,-0.6037795,0.49106082,0.14854923,0.11367828,0.23474641,-0.7070706,-0.108657144,-0.29458988,0.074549645,-0.22099498,-0.07853206,-0.038070902,-0.20543064,0.65486735,-0.9849831,-0.29538763,0.16876666,-0.33575913,-0.22077753,-0.39846033,-0.8045692,0.46266297,0.574283,-0.93924516,-0.14261594,-0.17394903,0.40632632,-0.28999394,0.7043416,-0.75065804,0.5444275,0.089075804,0.026978232,-0.05453005,-0.07338324,0.5153023,-0.46650288,0.096040405,0.20875232,0.4060048,-0.39957732,-0.15844978,0.589127,0.3605901,0.5728438,-0.44552407,-0.46183446,-0.3161373,-0.97982055,0.06092407,0.37597817,0.009347958,-0.6857368,-0.022209805,-0.082131624,-0.07522141,-0.10921287,0.13889807,0.060456574,-0.42179188,-0.10876264,-0.57886595,0.3479386,0.98544735,0.40221974,-0.50618386,-0.47154027,0.16834378,0.046758134,0.38665664,-0.14712901,0.6204462,-0.03828394,0.020228412,-0.083861455,-0.7692439,-0.47942945,-0.12769309,-0.2313573,0.8649033,-0.001105103,-0.10461252,-0.22309543,-0.79868454,-0.38276625,0.15543151,0.1330365,-0.08554745,-0.007462361,0.42678466,-0.9997959,-0.33828443,0.086928815,0.29100162,0.55665195,-0.08381525,-0.027780209,0.06379142,-0.53403014,-0.32292718,0.58115315,-0.6305288,-0.4236677,0.27141094,0.40543652,0.2255537,-0.7151076,0.8486501,-0.5439166,-0.47351098,-0.6411405,-0.25044155,-0.4042803,0.07273218,-0.21803859,0.07846457,-0.5728558,0.088962704,0.678426,-0.47497475,0.9992084,-0.51775545,0.7354657,-0.22726297,0.19389422,0.05162465,-0.005734274,0.5526694,0.55274534,0.065965176,0.9987428,0.16065618,-0.14406987,-0.18368174,0.6752017,-0.9890605,-0.99223137,-0.5786282,-0.3972381,-0.23608664,-0.32536897,-0.29033738,0.3924454,-0.13642557,-0.9029259,0.9875181,0.15689732,-0.26657757,0.23142551,0.04210421,0.5636331,-0.369778,0.12164532,0.39576286,0.11312274,0.032802545,-0.31647733,-0.9794858,-0.30577815,-0.13036261,0.5163838,-0.0068722,-0.8350552,-0.16921511,-0.027885713,0.24703865,-0.9771841,0.37117544,0.25065768,0.31151152,0.46742284,0.48794466,-0.54175115,0.07069608,0.75032586,0.1281553,-0.09097803,0.50680995,0.21973138,0.7496533,0.26286992,0.06806598,0.7990105,-0.099241234,0.29689115,0.19142003,0.15047432,0.10034808,0.9358958,-0.99664843,0.25244394,-0.5016484,-0.48166057,0.1214146,0.16072075,-0.3166319,0.9978157,-0.6984602,-0.19750214,-0.32566646,-0.19532208,0.26808244,-0.26556563,-0.27513456,-0.4901868,-0.6842834,-0.76993984,-0.40193698,-0.08494697,-0.53009903,-0.73762023,-0.83176976,0.92478395,-0.44889048,1,-0.251585,0.4082997,0.25848657,-0.17469753,-0.8038416,-0.39790127,0.7683225,0.08690031,0.4725126,-0.581115,0.13759586,-0.2874945,-0.30766788,-0.09392653,-0.40304068,-0.26020473,-0.6395079,-0.3689191,-0.076922424,-0.9507354,0.7010961,-0.16739091,-0.6795448,0.35671043,-0.7910046,-0.31665957,-0.32472986,-0.3377294,-0.3183793,-0.51712793,-0.5104181,-0.28014392,0.03518243,0.3588127,0.54434,-0.3453992,-0.036096513,-0.67176074,0.24447946,-0.31684417,0.9999496,0.63455814,-0.7835717,-0.2615156,0.99842215,-0.3676737,0.282452,-0.9987296,-0.3468488,-0.19922458,-0.7564858,0.11999767,-0.13275793,-0.084956884,0.43985057,-0.7464343,0.16611911,-0.16346984,-0.15493704,-0.4305142,-0.14140347,-0.13106035,-0.9997961,-0.99999994,-0.9826013,0.25188887,-0.565025,0.576257,0.46188343,-0.38844278,0.82701904,-0.1786306,0.52709216,-0.27461705,-0.09728686,-0.20277485,-0.2613465,0.59349686,-0.094470195,-0.5777441,0.24617845,-0.9689443,-0.9996336,-0.767292,-0.6495267,0.7105968,0.38410994,-0.20877777,-0.9792866,-0.41168988,-0.26134536,-0.3697019,0.005633141,0.2931242,0.5803354,-0.8848145,0.3168499,-0.6058951,0.42337614,-0.47353745,0.16990629,-0.7207205,0.61984766,-0.50239676,0.30463225,0.30278644,-0.68554,0.6733673,0.20935176,0.30619648,-0.35303274,0.07129584,-0.31474388,-0.8486484,-0.2976715,0.25581428,0.018458731,-0.69610155,-0.29176992,-0.33639073,-0.042235807,-0.006340737,-0.001836031,0.99998605,0.7627621,-0.17769435,0.10021058,0.14371784,0.110585496,-0.07928607,-0.31498194,0.26098743,0.33363613,-0.40886876,0.84701735,0.25431645],
    [131,1,"COCC(C)N(C(=O)CCl)c1c(C)csc1C",-0.8581251,-0.017268406,0.11325359,-0.83880246,0.46147394,0.3134866,0.17304315,-0.12737449,0.52917707,0.6632269,-0.5747996,-0.50221014,0.40713936,-0.30910596,0.3552204,-0.61992526,0.052328836,-0.047492083,0.38342363,0.06691107,-0.41249555,-0.071652375,-0.28598067,0.0679025,0.621624,0.5246031,-0.21499826,0.16805628,-0.5084604,-0.1070097,-0.24881953,-0.40962842,-0.66941506,0.2933189,-0.5412729,0.1656321,0.38265562,0.2538338,0.96520734,-0.8058028,-0.9258367,-0.08941377,0.3252878,0.35473806,0.16735508,-0.9715397,-0.6261323,-0.26255652,0.9880323,0.6051182,-0.40780333,-0.58627135,-0.14580978,0.015591161,-0.84863335,0.03456217,-0.17003526,0.62401146,-0.17280482,-0.228711,0.0758842,0.22475669,-0.010617899,0.31182805,-0.313032,0.17069186,-0.16474661,-0.40902695,0.1901317,0.24520174,-0.9535551,-0.96949655,-0.20575269,-0.007535984,0.59460455,-0.7988156,-0.034019567,-0.16916354,-0.28775594,-0.99984527,0.2884822,-0.5045955,-0.8586488,0.10876981,-0.48163018,-0.3803615,0.7024652,-0.6212308,-0.3681566,0.39784122,0.1645919,-0.05436671,0.07074173,0.37266833,0.9810956,-0.25616395,0.54320925,0.14687306,0.51368326,-0.16230024,-0.30530965,-0.039262,0.22111487,0.021375181,-0.69647306,-0.5547909,0.62062347,0.19480814,0.97598577,-0.5292257,-0.022145044,-0.35557312,-0.31626827,0.032504376,-0.6107441,-0.06316712,0.3868587,0.46332532,0.99882746,-0.5436201,-0.47958192,0.16770715,0.58714753,-0.5536319,-0.29580826,-0.047839575,0.61729175,0.33664703,0.059907366,0.9990459,0.8316537,-0.20762284,0.51766795,-0.42541584,-0.2859811,-0.99416584,0.44142833,-0.5568971,-0.7591139,-0.9367016,-0.9991449,-0.21854247,0.97148263,-0.18365708,-0.6819311,0.18350206,-0.20579569,-0.00434313,0.48230582,0.12028149,-0.13229263,0.21170786,0.020716637,-0.06147367,0.008967369,0.48369694,0.40760323,0.96004826,-0.86241037,-0.97541064,-0.9667595,0.60045534,-0.050627545,0.13566464,0.6712888,0.61480254,0.39093518,0.012667932,-0.31829938,0.17881045,0.27910006,-0.5531771,-0.530466,0.5349803,-0.5459808,-0.6994495,-0.559069,0.19272974,0.049176626,0.352276,-0.47841948,-0.58802825,-0.3423593,0.17837249,0.06545392,-0.2948487,-0.47998458,-0.059438426,0.242752,-0.36548212,-0.4672983,-0.7369019,0.17913407,0.13682945,-0.66005456,-0.7542707,-0.37319815,-0.77975476,0.4803811,-0.16092785,0.6448899,0.13634776,-0.11315341,-0.82557446,-0.22577582,0.13201948,-0.051549032,0.6069206,-0.32363054,-0.999032,-0.015337152,-0.16825132,0.39443165,-0.3615044,-0.34626064,0.044251256,0.42502624,-0.5675627,-0.67379147,-0.73521745,0.35128936,-0.43066803,-0.49672854,0.20165424,-0.99402976,-0.06705838,0.45085952,-0.39305952,-0.016429145,0.58079076,0.48658583,0.27385896,0.12003777,-0.27320257,0.52031916,-0.16610594,-0.37570053,-0.32309398,-0.7255721,-0.25350878,0.7553355,-0.4903965,-0.2577187,-0.4841324,0.028179308,-0.6451209,-0.03309734,-0.6336382,-0.35172313,-0.14652781,0.62838674,-0.9986888,-0.049924638,0.44619253,-0.12994291,-0.040805515,0.4820969,-0.68792063,-0.06416026,-0.30849984,-0.4959867,-0.4219035,0.3861278,0.7614565,0.042200066,-0.2955206,-0.80159825,0.13669695,0.9896905,0.12306365,0.7699202,0.9964563,0.4444878,0.58693415,-0.7453554,-0.8538787,-0.43140244,-0.48733872,-0.5876079,-0.47822303,-0.17064281,0.9988527,0.18114172,-0.5364738,0.05161616,-0.24011059,-0.1274204,0.83870256,0.92759705,-0.04281956,0.029732913,0.9958841,-0.46810076,0.9418043,-0.10797432,-0.8782936,0.99900275,-0.9652407,0.11927828,-0.43339598,-0.1470131,0.2861918,0.022482106,-0.68872136,-0.42000213,-0.008435115,0.48451796,0.04542294,0.017259054,-0.006594597,0.48588184,-0.4479129,0.34570703,0.17684384,0.3011148,-0.3843587,0.11754645,-0.50700915,-0.99997365,-0.27740705,-0.61059153,0.21928766,-0.7005198,-0.038177397,0.5565652,0.19593227,0.11578986,-0.70277625,-0.018382862,-0.106735654,-0.6323948,0.5351879,-0.24242042,0.53988767,-0.5691194,-0.06544946,-0.6728434,0.06088627,-0.5093292,0.1849255,-0.38224176,-0.29759213,0.6217379,0.20798637,-0.59256816,-0.5812167,-0.059615582,-0.28637084,0.60464233,0.4204172,-0.9792677,-0.49763095,0.17131773,-0.07970382,0.6154797,0.6905262,-0.52453715,0.9997937,-0.13563018,-0.5548156,0.045176998,-0.025693826,-0.78646827,0.2628824,-0.56226474,0.3706386,0.83070767,0.18488617,0.76549655,-0.7942891,0.2811239,0.14149761,-0.10018352,0.037656687,0.54888946,1,-0.49065778,-0.4036687,0.1484354,-0.14066878,-0.46617618,0.698371,-0.51937884,0.44432712,0.50400865,-0.8149035,0.57895,-0.7947848,-0.085623875,-0.017050693,0.103444375,0.62926954,0.18293187,0.50462115,-0.30300498,-0.9090074,-0.26927257,-0.40797675,0.7732793,-0.4632444,-0.5615506,0.5419397,0.17865671,0.10262954,0.32680863,0.30566552,-0.36949077,-0.7382469,-0.07654756,-0.12198494,0.08253478,0.05869169,0.41266057,-0.061139423,-0.004247126,0.21366343,1,-0.47877786,-0.9833291,-0.24495232,0.9996098,0.11664653,0.056977864,-0.99996805,-0.33698002,0.4225352,0.4061375,-0.3045237,-0.515059,-0.56259924,0.7267282,-0.084406145,-0.12611842,-0.32336497,-0.38354897,0.27940872,0.89538515,0.38288316,-0.9999776,-0.99597055,-0.96062464,-0.15371531,-0.5342032,-0.58395565,-0.26519278,-0.2410399,-0.83743435,-0.48227167,-0.23013434,-0.3234348,-0.05046708,0.00774368,-0.56378835,-0.13357149,-0.3502897,0.37707233,-0.6486414,-0.76147866,-0.99984425,-0.45272872,0.6980637,0.19930354,0.4190675,0.33276093,-0.93394417,-0.5337001,0.4232937,-0.1622396,-0.121718526,-0.2287347,0.5453856,0.96894246,0.2614025,0.50564,-0.15500177,0.62754697,-0.011486092,0.54898447,-0.37944835,0.16488636,0.03775826,-0.2890357,0.7521743,0.29127303,-0.19484743,-0.2650528,0.15345682,-0.40587905,0.45563427,0.5983493,0.22487316,-0.16040541,-0.31678852,0.8381239,-0.5880565,0.406515,-0.14123018,-0.6575812,0.47540304,0.99995536,-0.17230521,0.009039122,-0.13923535,0.16693121,-0.4220817,0.51057875,-0.9712126,-0.5746707,0.59190315,0.42897353,-0.029370096,0.4977627],
    [132,1,"CCCCCCCCn1sccc1=O",0.18518427,0.30074385,-0.28226358,0.046743922,-0.6622189,0.21980706,-0.082987964,0.18144737,0.5321633,0.5402145,-0.48995045,-0.6652403,0.4031125,-0.71525246,0.41862082,0.56302464,0.70702744,-0.59360164,0.26285592,-0.50972456,-0.17365502,-0.74986905,-0.4596539,-0.14278388,0.2676717,0.30368277,0.005484968,-0.585294,-0.022830693,-0.44092858,0.0547932,0.51255935,0.31981072,0.07753288,0.20234463,-0.37858003,0.6724753,0.19604024,0.22881459,-0.8622705,-0.996829,0.28985336,0.2074793,0.6238419,-0.71264243,-0.9884345,0.26308367,-0.52487427,0.977667,0.30773377,0.41587532,0.6673774,0.19801703,-0.44586647,-0.8204034,-0.35751927,0.84317136,0.96034795,0.06497958,-0.013805809,-0.15723705,0.10499558,-0.012905394,0.45094663,-0.29935583,0.13704741,0.03746224,0.31615725,0.6847062,0.072278865,0.52444607,-0.9597461,-0.23985074,0.04411386,0.43778175,0.01592549,0.057450555,0.49060902,0.21801789,-0.99990654,0.09606822,0.36575451,-0.91480416,-0.43284547,0.12776077,-0.6149445,-0.45214123,0.11094561,-0.2612106,-0.48956436,-0.61183953,0.03536248,0.009233866,0.095617026,0.89898694,-0.35684824,0.5754422,0.2856031,-0.105029374,-0.14691444,0.13089865,-0.23269573,0.5638042,0.83653414,0.81715864,-0.6058575,0.094521664,0.8423437,0.99127305,0.5794582,0.43117663,0.2596426,0.56546,0.18364239,-0.6154484,0.45543423,-0.22884877,-0.26750132,0.9971066,0.44941568,-0.33320248,0.035920758,-0.236642,-0.42216334,-0.3490612,0.31673443,0.1827332,-0.12646796,0.312511,0.99977326,0.4737036,0.68160635,0.022933029,-0.13253802,-0.2659954,-0.957655,-0.6914506,0.32441223,-0.121140674,-0.55361074,-0.9966036,-0.47512913,0.98649794,0.22252211,-0.80528194,0.33951783,0.3883453,-0.33672017,0.98675257,0.29159576,-0.6300316,-0.78819275,0.050647013,0.5705531,-0.3372993,0.16355963,0.6940791,0.99815977,0.263853,-0.9351289,-0.9872446,-0.3759139,0.47612134,0.25049958,0.55821824,-0.49683315,0.01135529,-0.12995389,-0.20538038,0.097957335,0.22529317,0.6659187,-0.43603158,-0.32826424,-0.003385512,-0.39797786,-0.3892663,0.5580368,-0.47153592,0.5180609,0.024293557,-0.054372635,0.6057642,0.2034635,-0.92899877,0.016865103,-0.43168175,-0.07641433,-0.74597317,0.42644894,-0.8796727,0.7944722,0.19732836,0.29951587,0.2951063,-0.3384746,-0.30874783,-0.8319668,0.1712309,0.4336271,-0.16861324,-0.6232957,-0.28684625,0.12153015,0.17614251,0.15345448,-0.19577773,-0.64717144,-0.4911777,-0.9698638,0.031169668,0.24107727,0.061569683,-0.3748401,0.009659466,0.03169654,0.32669574,-0.30342183,0.36732748,0.62718934,-0.45172593,0.28308904,0.51919526,-0.5236387,-0.9744497,0.7078562,0.34018797,0.38034356,0.19789174,-0.24912041,-0.40916073,0.26450488,0.47539982,0.29617006,0.08542932,-0.29758316,-0.32600132,-0.5919018,0.027729528,0.32435656,0.8422369,-0.87733805,-0.63789743,-0.12941444,-0.47703847,0.02067607,0.42473006,-0.5513896,-0.21072899,0.6423625,-0.024030905,-0.99794906,-0.39917043,0.56591856,-0.32442078,0.09732647,-0.24259932,0.2404719,0.3289453,-0.59530485,-0.32754242,0.19678974,-0.52801216,-0.5336716,-0.00255047,-0.21627095,0.4182753,-0.706863,0.21857187,-0.4939497,0.69702065,0.41727707,-0.4647814,0.41957164,-0.37108815,-0.22058007,0.30180192,-0.49441338,-0.03787544,0.7122923,-0.47541225,0.99920326,-0.5255506,0.39715588,-0.52346665,-0.28442731,0.5473142,0.8699539,0.9872944,0.39818105,-0.4719086,0.9993064,-0.33273995,0.09592023,-0.40616706,0.68602604,0.9977785,-0.9869566,-0.21850042,0.5013333,0.4210889,-0.3286229,0.22509357,0.74276763,0.46564904,-0.56607074,0.9820406,0.85122,0.16595751,0.50329804,0.006107447,-0.23608562,0.2852249,-0.514252,0.76704484,0.14174956,0.73857176,-0.3373444,-0.99998957,-0.38926315,0.22475012,0.625878,-0.22530596,-0.6009165,0.38567308,-0.60886806,-0.19589937,-0.860949,-0.4263166,0.47825155,0.44898635,0.04530635,0.31482977,-0.3142762,-0.05521062,0.5247518,-0.20780586,-0.018343506,0.60177344,-0.6590407,-0.17015235,-0.003454568,0.4334222,0.56173915,-0.100481816,-0.2887453,-0.06968926,0.029333612,0.32812425,0.91172737,-0.994956,0.2907907,0.0676253,-0.013326682,-0.2445667,-0.13024405,0.14468527,0.99841094,-0.6223668,0.09210525,0.082085945,-0.35213527,0.53884083,0.33076125,-0.19300203,0.34653965,-0.55300444,-0.8304078,-0.4802892,-0.4705103,-0.6718358,-0.56605667,-0.64019907,0.6849493,-0.00144747,1,-0.33893153,0.102168836,-0.11728628,0.18468988,-0.4454957,-0.31045654,0.8761503,-0.49960142,0.72933793,-0.19309928,0.2677778,-0.3587554,0.040947374,0.30948785,-0.012418511,-0.6910157,-0.5553884,-0.3356611,-0.087639295,-0.85562646,0.36976296,0.1261381,-0.7088797,-0.31665552,-0.7655644,0.3433488,-0.5064542,0.6332797,-0.26173878,-0.35278445,-0.786415,-0.4225206,0.3771247,0.5359626,0.6226143,-0.45151994,-0.6405555,0.33387324,0.12609923,-0.084453866,1,0.23486511,-0.9901555,-0.068706304,0.999486,-0.19021943,-0.32310686,-0.99997675,0.26066923,-0.72451234,-0.26794457,0.002071109,0.5754586,0.09351233,0.3402478,-0.34854296,0.29120556,-0.47940916,-0.019717555,-0.3045291,-0.374837,-0.5607915,-0.9997823,-0.9990307,-0.97181976,0.41572,-0.035391156,0.24462457,-0.5729837,-0.030652925,0.8748566,-0.71924865,0.6151429,0.40984178,0.50447476,-0.006313337,-0.37340018,0.33173952,-0.07296866,-0.7453227,-0.19979452,-0.9811993,-0.99949753,-0.65763026,-0.09430082,0.61429554,0.069256775,0.40227,-0.9883002,-0.37768024,-0.3468491,-0.27323157,0.1401763,0.3388367,0.26727697,0.90112007,-0.28437197,-0.29193333,0.7278749,-0.07491193,0.25517282,-0.22891329,0.4535259,-0.48229635,-0.4937308,-0.17637478,-0.51878124,0.43125394,0.60482687,0.03922181,0.000868045,-0.20617622,0.04469504,-0.61012113,-0.33257985,0.012661904,-0.539654,-0.6823536,0.19002597,0.01822473,-0.51553017,0.283446,0.47765806,0.999919,0.14459138,0.16447084,0.61831266,0.27077025,0.055560116,-0.038940083,-0.341989,-0.19173454,0.62258834,-0.5991815,0.14624679,0.45662445],
    [133,1,"CC(c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc(O)cc1",-0.7648181,-0.23060606,-0.07341814,-0.6229701,0.7906535,-0.6354852,-0.8061396,-0.4368207,-0.11038506,0.23796216,-0.8407705,0.40032133,0.012248928,-0.8116789,-0.07574766,0.7913894,-0.52042586,-0.007689565,-0.41853946,0.19458763,0.17806907,-0.5851329,0.70823544,-0.24391828,0.015933475,0.38268366,0.3624607,0.17179711,0.9060922,-0.16643226,-0.23773424,-0.2785438,-0.4210418,0.5297001,0.001258287,-0.55213535,0.1331482,0.29252505,0.9982583,-0.7921647,-0.27301,0.18526332,-0.25960264,0.04716929,0.24415377,-0.5900912,0.20803688,-0.07270711,0.90803707,0.05740779,0.39774054,-0.077764235,-0.37894908,0.11352503,-0.87486804,0.3626266,-0.6606022,-0.17538203,0.5286438,0.020835485,-0.33630607,-0.017143585,0.50982606,-0.4471663,-0.18470187,0.6813354,-0.28068048,0.5329012,-0.28382158,0.42341802,-0.24157022,-0.5339713,0.38240165,-0.11318881,0.87662715,-0.17212394,-0.029946946,-0.20945024,-0.5766623,-0.99004376,-0.95877075,0.48844635,-0.85732865,0.16462396,0.012137522,-0.88029474,-0.046549283,-0.45830554,-0.41131705,-0.5348792,0.5335827,-0.19489452,-0.26265118,-0.29515144,0.88916355,-0.07025539,0.5394339,-0.082957454,0.23967251,0.06515546,-0.054408874,0.43483925,0.12611564,0.93142146,-0.9937557,0.39544907,-0.42586428,0.46430987,-0.99995303,-0.28325447,-0.48273808,-0.3277056,-0.40133727,-0.011112231,0.25223002,0.78621167,-0.3148067,0.44111726,0.99006534,0.2527162,-0.51187456,-0.56950414,-0.6057161,0.24435794,-0.775065,-0.1501045,-0.32708764,-0.21267214,-0.7264607,0.99982315,-0.51702625,0.11761663,-0.03177324,0.024282692,-0.262222,-0.5907042,0.6929856,0.8943075,-0.8118714,-0.6567723,-0.9999959,0.5009453,0.93696475,-0.06337933,0.28627437,0.14757569,0.06373561,-0.08505052,-0.91790795,0.22252995,0.33609563,-0.8414753,0.4815672,-0.14004433,-0.25112352,-0.14674233,0.15713243,-0.14896578,-0.84300435,0.10051544,-0.8849131,0.045057714,-0.012405536,0.027527018,-0.20313062,0.47329417,0.66284406,0.3646718,-0.50307375,-0.6876047,-0.448528,-0.12399016,0.26874685,0.11823032,-0.27896953,-0.97397465,-0.81376237,0.36564395,-0.48419857,-0.41611037,-0.077538945,-0.23753887,0.16853571,0.65030086,0.4943491,0.031537257,0.059181027,0.5007219,-0.4173958,-0.22213767,0.4740322,0.02940117,-0.1339656,0.4975507,-0.30824527,-0.6170599,-0.13760376,0.75913435,0.35269985,0.11312927,-0.4429666,-0.32456276,-0.54424006,-0.12950155,0.5446021,0.01257439,0.37556717,0.14452237,0.16965558,-0.99984765,-0.5859585,0.39880309,0.3880285,-0.21959715,0.36405584,0.110513486,0.061691403,0.69069844,-0.5979626,0.44347998,0.07913805,-0.23650786,-0.4229233,-0.36427325,0.9999964,-0.40414017,0.13174409,0.47811383,0.36405632,0.5325903,-0.44461992,-0.77240247,0.78460693,-0.26269665,0.4768693,-0.34025794,-0.36501548,-0.37167203,0.054762926,0.6187752,0.7284036,0.39506844,0.16014273,-0.77715117,0.79012275,0.16368484,0.51777756,0.3999419,-0.28232569,0.24421942,-0.42377818,-0.7720272,-0.40226158,0.28063452,0.38456196,-0.6382208,-0.30118966,0.24329239,0.71593136,0.11705468,-0.6393829,0.3956296,-0.18994345,-0.3691723,0.30935302,-0.17847499,0.36189032,0.32179096,-0.9241487,0.37920132,-0.6554697,0.95269746,0.035045605,0.100977354,0.03516414,0.5449141,-0.08388134,-0.14823857,0.14652634,-0.2370536,0.57747364,0.9975239,-0.24098355,0.36672726,0.21145165,0.3975164,-0.2078891,-0.32320663,-0.92743963,-0.3537865,0.53227216,0.9102094,-0.15986331,0.44509178,0.08218467,-0.59135616,0.9999997,-0.99509627,0.5762272,-0.39967558,-0.20974697,-0.49032205,-0.590798,0.26271194,-0.17434718,-0.9831095,-0.9218313,-0.25678682,0.6892982,0.24574539,0.5003165,0.029532768,0.5033601,-0.27075484,0.6308664,-0.51140136,-0.37655428,-0.33127406,0.9996211,0.47417822,-0.5934328,0.09469256,0.43661055,-0.7285214,-0.7475813,-0.37527177,0.28143638,-0.8371099,0.05022914,0.037137434,0.5799541,-0.39171824,0.33790216,-0.5297838,-0.22031994,0.80118364,-0.4625591,0.5957428,-0.19430041,-0.058417294,-0.71630317,0.25932884,0.3559761,0.16558303,-0.1048868,-0.45044395,-0.79256064,-0.7751371,-0.48235044,-0.6785947,-0.93453246,0.010697536,-0.60927767,-0.108210534,-0.25477552,0.2579805,0.42379576,0.99948245,0.04539158,0.2918484,-0.23614448,-0.059605632,-0.6168492,0.28273255,-0.95494133,0.32390136,-0.13393699,-0.019103006,0.053460017,0.5170552,0.50462157,0.57074124,0.80034935,0.5762979,0.57283247,-0.99270916,0.5050514,-0.07639887,-0.3756802,0.5589936,-0.6113707,0.07248666,-0.7457005,-0.683379,-0.2940088,0.018251432,0.5141981,0.2675157,0.23972094,0.56668496,0.17354405,0.45361227,-0.18862566,0.19896647,-0.27296537,-0.17091851,-0.63962734,-0.4712798,0.7381946,-0.18272908,-0.31316656,0.4043826,-0.60964954,0.30580932,-0.34871474,-0.30553797,-0.52568465,-0.71495897,0.069394566,0.15504088,-0.06699216,0.6830902,-0.36650285,0.5164923,0.43422875,-0.57276034,-0.8229147,0.07802206,-0.9750701,0.16481492,0.9981315,-0.5539135,-0.3723393,-0.7721593,0.22547992,0.4392736,0.70752776,0.4686949,-0.64265996,0.80584776,-0.69656307,-0.8101758,-0.6355967,-0.11971576,-0.64842606,-0.2699925,0.20042999,-0.040970065,-0.99998224,0.9999994,-0.45716706,-0.16960253,-0.08085811,0.41992727,0.040436216,-0.8858047,-0.59820604,-0.15343338,-0.5212596,-0.29750785,-0.93405664,-0.5313962,0.028096134,-0.64718515,0.1761594,0.0833019,-0.250407,0.5072566,-0.9998903,-0.5040965,-0.6393273,-0.43107948,0.6010056,-0.19126092,-0.9615068,0.1864923,-0.8242518,0.35937786,-0.14663033,-0.28128806,-0.46735126,0.9785895,-0.5365314,-0.6431369,0.44514686,0.71027035,0.23103595,-0.95343816,-0.2797153,-0.50918305,-0.113404416,-0.041328102,-0.9798896,-0.29732132,-0.20227188,-0.4464932,0.06869607,-0.7345562,-0.033342287,0.7268117,-0.5942097,-0.11890737,0.49736008,0.99296737,0.19607481,-0.2977006,0.3918678,0.392507,0.30057794,0.9989443,0.7343741,-0.49352285,-0.67403316,0.39352837,0.4420357,-0.29829904,-0.99308926,-0.12554598,0.74716794,-0.28494558,0.43574792,-0.16105375],
    [134,1,"NC(=O)c1n[nH]c(-c2cccc(-c3cc(F)ccc3OCC(F)(F)C(F)(F)F)c2)n1",-0.77935445,0.21331102,-0.27812415,-0.13725841,0.56858516,0.028462507,0.046394676,0.1802736,0.42767382,-0.72842103,0.35506013,-0.11392003,0.6449232,0.7383181,0.5345238,-0.7622763,-0.055693362,0.2706776,-0.14674582,-0.27946913,0.1872432,0.49529374,-0.1613173,0.14133625,0.55375385,0.43146244,0.48503348,-0.06256402,0.74023086,0.5289132,0.7381938,0.29575822,0.014607826,-0.68177706,0.019724615,0.4393006,-0.50035924,0.60753685,0.9995601,-0.09550823,0.5136384,0.43097112,0.44433296,-0.22418918,0.016372453,0.72748476,0.099881224,0.4622483,-0.08092191,-0.14147271,-0.07092781,0.07197255,0.37713066,0.16667831,-0.106764376,-0.6528206,-0.3688226,-0.92852336,-0.6421506,-0.63265157,0.7647391,0.079162985,0.17024465,-0.269099,-0.060213424,0.24984139,-0.010265395,-0.22194988,0.7046579,-0.1288864,-0.9664103,-0.72689986,0.026528932,-0.8216516,0.32218146,0.68215126,0.58945704,-0.22159441,-0.19728062,-0.9980877,-0.24086264,-0.536999,-0.95513314,-0.68744045,-0.33142388,-0.91189593,0.06763303,0.3436998,0.15857095,0.48487112,-0.52178687,0.62030196,0.2415165,0.25020742,0.9982413,-0.5454137,0.23553652,0.7214074,0.16086306,0.39985734,-0.19675423,-0.21121773,0.020570738,0.9688362,-0.9995684,-0.8086138,0.09477391,-0.5975801,-0.999671,-0.7915425,-0.6878006,-0.40470544,-0.23811427,-0.009054617,0.28682572,-0.599046,0.5464312,0.7258797,0.81320554,0.14670436,0.12847131,0.36728308,0.07679153,-0.15695214,-0.3329472,0.43568757,-0.744193,-0.7638268,-0.37987533,0.9996332,-0.40437654,-0.007829714,0.411545,0.28347498,0.43489942,-0.903131,-0.16216277,0.36214697,0.20882036,-0.54484487,-0.9999943,0.08793736,0.05937379,0.072223805,0.6357641,0.35380885,0.5081,-0.6768715,-0.9976853,0.49607575,-0.081407025,-0.040481556,-0.09139494,-0.2027323,-0.8029894,-0.3312204,-0.245335,-0.9698599,-0.1509842,0.067263946,0.19881158,-0.21552095,-0.18473722,-0.6722814,-0.09926144,0.6084792,-0.54041004,0.5027223,-0.8563524,0.05169798,-0.6294319,-0.7960082,0.026139405,-0.10042445,0.4548093,-0.2899827,-0.6336365,0.42718285,0.054590635,-0.31272915,0.46874145,-0.93387145,-0.71983904,-0.42450026,0.78819734,-0.35514987,0.69170773,0.5416318,0.19963336,-0.36784106,-0.13301502,0.45226884,0.17832471,0.4588113,0.82839966,0.24565125,0.14740361,0.060195386,0.45558882,-0.20195162,0.16325451,0.30155286,0.16665092,0.31239808,0.6279541,0.2869845,0.90887356,-0.15517974,-0.3601635,-0.99985474,0.4907293,0.09511381,-0.2271729,-0.22011875,-0.6065352,0.7803975,-0.22490652,0.33002612,0.10292109,-0.24171142,-0.14289823,0.42078093,0.36692572,-0.5658673,0.98084676,-0.61146307,0.6546426,-0.23094594,-0.6017871,-0.51959205,-0.8606686,-0.58736503,0.14554222,-0.34666997,0.6919833,0.078029156,-0.023628604,-0.25125375,0.1510119,-0.4729361,-0.970837,0.6997147,0.45074147,-0.17958425,-0.34259027,-0.34151292,0.2644388,0.7333503,0.15320197,0.033090036,0.52033114,-0.8186848,-0.58354,0.48567992,0.39003557,0.29929012,-0.23717746,0.50404483,-0.57095575,-0.1315463,-0.1311597,-0.37679052,0.1839312,-0.38099527,0.32348403,0.12061876,-0.556924,0.21275362,0.7351441,-0.20533828,-0.8106198,0.9988896,-0.29084972,0.18166319,-0.3797784,0.8456361,-0.06682036,-0.15912488,0.26659775,-0.6190557,0.44643667,0.9594151,0.20818841,0.479823,0.45479396,0.383413,-0.87426037,-0.004954016,-0.9678903,-0.6303854,0.8817267,-0.4782333,0.022704717,0.1138857,-0.5358067,0.24074413,0.99999064,-0.98462564,-0.63276297,-0.32850948,0.71791184,-0.6378004,-0.71599716,0.40682352,0.9307812,0.52992874,-0.9989619,-0.35367674,0.6584753,0.5138005,0.7069866,0.7038588,0.2808397,-0.7985994,0.23848006,0.35076514,-0.7857284,-0.43724447,0.93034434,0.305502,0.8566334,-0.31488076,-0.42182302,-0.47134694,0.03374843,0.5953917,0.4111088,-0.84556866,-0.8772858,-0.7296997,-0.7865495,-0.009981181,-0.12867603,0.17977372,0.06715565,0.6079521,-0.20444457,-0.7072333,0.31037953,0.0727284,-0.2940832,0.6101683,0.07472634,-0.5471858,0.016080765,0.110452466,0.5819275,0.48768392,0.7488301,-0.9697393,-0.33019793,-0.06713656,0.6127169,-0.5258325,-0.07589728,0.05874502,0.07941732,0.99933094,0.4464254,-0.6672748,-0.7543021,0.2592161,0.4728805,0.35094944,-0.841475,0.42201832,-0.09737108,0.387555,0.01929532,-0.17591095,0.3467783,0.48267892,0.4939284,-0.8205645,-0.20991246,-0.9949208,-0.16703482,0.13125557,-0.06177457,-0.00290913,-0.006542447,-0.08187786,-0.011156747,0.3550775,-0.10698561,0.32604244,-0.36930624,0.5024206,0.6124538,0.64304894,-0.41068792,-0.47792777,-0.014461953,0.8231898,0.69993347,-0.3603355,0.02255864,0.098106064,-0.037212167,-0.30847925,0.95387536,0.57192034,-0.28383532,-0.44642487,-0.38626483,-0.4233961,-0.38954207,0.07552926,-0.48616546,-0.47662005,0.15061232,-0.17320137,0.40098011,0.7654855,0.6280725,0.21403544,0.93323976,0.44613707,-0.96844065,0.34732208,0.9980274,-0.80479544,0.346734,-0.9870769,-0.43767685,-0.583323,0.47905928,0.6476976,-0.2267881,-0.016382882,0.35099345,-0.77622193,0.41537055,0.1362695,-0.14698626,0.1766453,-0.57743925,0.21674903,-0.9999454,0.99999976,0.7869611,-0.57925075,-0.39821327,-0.80808944,0.13778846,-0.5888614,0.07432851,0.22768968,-0.84826165,0.69807965,-0.89522904,-0.83645463,0.23733245,-0.44006416,0.39100927,0.116313964,-0.031502187,0.97953,-0.9989648,-0.05840738,0.058216684,0.4572765,-0.57538927,0.48368734,-0.31324962,0.23567593,0.25950697,-0.54820096,-0.7671557,0.7123973,0.099100806,0.99014515,-0.79662204,0.8324466,0.11991708,-0.4388766,0.23086023,-0.26509252,0.5618971,0.69557744,-0.7835144,-0.16441305,-0.9118618,-0.015967725,0.21997724,0.43632814,-0.2656654,-0.01447539,0.13678975,0.77742076,-0.71858954,-0.22811602,-0.45219103,0.9994878,-0.13025388,0.7932902,-0.7685662,-0.091562524,-0.21914048,0.9999088,0.37558272,-0.70987517,0.6724801,-0.1427114,0.18474428,0.089506276,-0.9988277,0.38823214,-0.08762939,0.112691276,-0.0741308,-0.41716075],
    [135,1,"C=C(C)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1",0.61076313,0.21975347,0.34943047,0.4040778,-0.012844628,0.119329534,-0.011621728,0.34619597,-0.57588875,-0.6627385,0.5543409,-0.3221814,0.46364403,-0.5490908,-0.18462431,-0.43118876,-0.104284756,-0.64565593,0.5979526,-0.48774686,-0.46315634,0.46007666,-0.2375165,0.43265793,0.24500233,-0.4338874,-0.68996245,-0.18841124,-0.20663066,-0.31362146,-0.40711093,0.08993905,0.6306667,-0.36527485,0.35891703,-0.004806273,-0.16729382,-0.086469255,0.99989754,-0.48675606,-0.36666667,0.3087569,0.12101324,0.41494885,-0.13999817,0.8657058,-0.31593868,-0.03320233,0.8098246,0.7435255,0.59325784,0.17643447,-0.16647735,0.15667434,-0.0589877,-0.72477937,-0.4834927,-0.9297659,-0.28415892,0.026570264,-0.09732646,-0.36595237,0.03387481,0.68873715,-0.5532609,-0.20298871,-0.38064012,-0.29183012,0.4355178,0.1532697,-0.52746373,-0.9080576,-0.42419323,0.25732124,0.07319906,0.42089438,-0.2505736,-0.50078696,0.58175457,-0.9996761,0.7501385,-0.4171868,-0.94283587,0.18751173,0.42750892,-0.8519693,0.07164806,-0.7913062,0.7076344,-0.46678782,-0.14627261,0.47238633,-0.31153747,-0.052051246,0.99925816,-0.61776215,0.5513267,-0.6719193,-0.7382719,-0.32165945,0.39828908,0.5650549,-0.17498346,0.7788898,-0.9997787,-0.82661414,-0.1829936,0.6469486,0.9520628,0.2432437,-0.43607184,0.041865665,0.7579149,-0.2955407,0.6087661,0.104405455,0.22963746,0.34118617,0.77016294,0.6098189,-0.10927012,-0.24131371,0.15743126,-0.11849914,-0.115815155,0.08523145,-0.4462676,0.2010247,0.097140335,0.99897534,-0.5562993,-0.26462522,-0.79198223,0.5637696,0.001848686,-0.9647315,0.3585469,-0.1583992,0.34998918,-0.67802244,-0.9999905,-0.60749495,0.11246742,0.18284349,-0.035472717,0.42320833,-0.042324927,0.5388736,-0.9989285,-0.19335195,0.5825885,-0.70151114,-0.24476075,0.14023976,-0.72419024,-0.45051128,-0.83161163,-0.96842957,-0.4262542,-0.8737075,-0.058137167,0.47051305,0.10414149,-0.46084112,0.29901868,-0.71575356,-0.6293907,0.6614408,0.10716201,0.17604645,-0.4276193,0.56471926,-0.3118072,0.19255522,0.12991878,-0.7652483,-0.34067196,-0.4320035,-0.3984236,-0.008206648,-0.19550411,-0.9233173,0.5913662,0.59900534,0.9137496,0.2810457,-0.45187527,0.04359768,0.50992507,0.7713516,0.4255033,0.60088027,-0.35477367,0.1384507,-0.47561082,0.16056445,0.048162628,-0.90869004,0.104089856,-0.36110967,-0.33533955,0.5407154,0.76211494,-0.1347434,0.4010938,-0.2176345,0.6419748,-0.40957677,0.32538065,-0.99993855,-0.16821884,-0.6165989,0.52916807,-0.6452083,-0.015523541,0.52109814,0.32419756,0.6234614,-0.44759715,-0.60057837,0.31477553,-0.26684725,0.10357207,0.64752305,-0.9807732,-0.2804554,0.043350223,0.49070454,0.35801086,0.68552893,-0.16819388,0.47284904,0.4349205,-0.09419896,-0.3443608,-0.013666888,-0.12613486,-0.06927447,-0.16397405,0.06862576,0.90873253,0.39137492,-0.20835191,0.214948,0.46247348,0.40542048,0.7787746,0.44093603,0.038588855,0.38772762,0.15272802,0.6509937,-0.06346336,-0.1063587,0.08353978,-0.2034324,-0.41012636,-0.17841318,-0.3207454,0.7181403,0.19198589,0.1735032,-0.4794324,-0.43203598,0.55603594,0.20288149,0.31563985,0.3683161,0.8961357,0.22617285,0.31172445,0.999894,0.5659101,-0.006342846,-0.31829762,-0.79202765,-0.85123765,0.14262103,0.6013874,-0.097496994,0.17887433,0.9406239,0.620667,-0.08998414,-0.65458727,0.10858443,-0.010572964,0.7949095,0.81829333,0.6591561,0.79015183,-0.37333485,0.7846175,0.07970069,-0.73471206,0.12889318,0.9999998,-0.9429101,-0.015644476,-0.8463189,0.3442038,0.27483925,0.48047733,-0.018960914,-0.67092234,-0.93692124,-0.9991197,0.066081606,-0.051576555,0.21442226,-0.46051896,0.40267622,-0.18512237,0.220563,0.16145265,0.13601042,-0.15102573,0.010324474,-0.9996915,0.46750668,0.7975206,-0.6077146,0.29405588,-0.32118464,0.6944486,0.17172465,-0.73789024,0.4102777,0.52071285,-0.019065408,0.06514007,0.62119824,-0.3288086,0.6821531,-0.6795883,-0.049928483,0.6045775,0.42285353,0.20310356,0.55674815,0.3940219,0.5290641,0.007433329,-0.5080036,-0.15417649,0.29701304,-0.32109302,0.031582914,0.43605414,-0.9773435,0.017817443,0.5062304,-0.25220436,0.50024444,0.34775048,0.4545734,0.12645026,0.9981366,0.29206657,-0.1426849,0.1788344,-0.047352783,0.73507965,-0.48758602,-0.7422904,0.001235096,-0.504512,0.818395,-0.32953176,0.3893458,-0.055517554,-0.44293544,0.53467953,-0.8052377,0.000871421,-1,-0.010176869,-0.42339832,-0.6395513,-0.12732038,-0.38703203,-0.49070558,-0.4393843,-0.41693264,0.11163351,-0.21526696,0.23184831,-0.5711084,-0.040898312,-0.84149253,-0.002699303,0.7044828,0.287351,-0.20282654,0.31877354,0.22188623,0.57552856,-0.6661209,0.55818814,-0.5269771,0.9478377,-0.39453334,-0.22245304,-0.29631612,0.5640783,0.20656356,-0.53425616,-0.38139504,-0.5977981,0.64741087,-0.8993786,-0.3686096,-0.27975166,0.05989029,0.4365035,-0.6173246,0.9999976,0.2169926,-0.9637793,-0.6434784,0.9984039,-0.49961963,0.63336456,-0.99988383,0.6294682,-0.83823895,-0.15138112,-0.044850226,0.011952765,0.049963057,-0.2511279,0.031264216,-0.38063216,0.15021142,-0.08700959,0.45751768,-0.3105295,0.21013533,-0.9997902,1,0.7302693,-0.3736633,-0.32582998,0.7046714,-0.0777972,0.4911962,-0.24676591,-0.7522825,0.124178216,0.48942125,-0.46785188,0.27740273,0.2344482,0.4800198,0.38706195,-0.6066673,-0.15126581,0.9682103,-0.9970176,-0.33910143,-0.5027668,0.033303585,0.22928314,0.11858305,-0.167397,0.4856647,0.38004762,-0.54065305,-0.3654121,-0.1790495,0.28896138,0.81906575,0.20657499,0.4762761,-0.56197464,-0.22544377,0.4665355,0.1396589,0.14180355,0.38350815,0.017453073,0.07819601,-0.97974336,0.3476481,0.13741618,-0.46621028,-0.47427636,0.6113888,0.36338446,-0.4075102,-0.5631066,0.08406027,0.13642396,0.9995291,-0.29283097,0.24945526,-0.7447669,-0.14292248,0.23645622,0.9999236,-0.18707377,0.5201345,0.2793664,0.1469495,0.31306082,-0.19380283,-0.99945354,-0.20215869,0.27760527,0.28411156,0.6892817,0.19599223],
    [136,1,"CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1",-0.7418599,0.22514899,0.19657025,-0.017087828,-0.11856028,-0.72879624,-0.5747363,0.088961765,0.14055808,-0.11231726,0.095604695,0.35151517,-0.7448237,0.73628527,-0.22341134,-0.70885044,0.17695762,0.23917396,0.12206981,0.3793564,0.32458284,-0.21163544,-0.053234015,-0.11404117,-0.1298688,0.8221109,0.4437242,0.1209011,0.25096327,-0.2564935,-0.21345292,0.41171733,0.218932,0.5717206,0.4000175,0.44591743,0.28328204,0.65214574,0.99385303,-0.011603527,-0.9718312,-0.38325816,0.045589183,-0.15444122,-0.16908178,-0.9022145,0.18344301,0.6283424,0.50922084,-0.48890692,0.643156,0.45912313,-0.6963951,-0.13926063,-0.44549167,0.12828751,-0.7080525,-0.28990322,0.21638976,0.31044888,-0.084109284,-0.41028944,0.37367484,-0.4062752,0.10103019,0.27525318,0.81208324,0.032324787,-0.14932634,-0.032183066,-0.8030703,-0.9913639,-0.15139951,-0.16134761,0.3305048,-0.03232763,0.09877569,-0.19916175,0.3075053,-0.9992307,-0.23500668,0.26883814,-0.8800639,-0.04470874,-0.46445394,-0.39631596,-0.21957472,0.12531304,-0.8178381,0.23399022,-0.36866266,0.18265347,0.6231915,0.095186114,0.9993953,-0.59949106,-0.0915254,-0.22844292,-0.17473915,-0.21068807,-0.26357836,-0.32882732,0.40284565,0.28141728,-0.9347714,-0.5142321,0.08581942,0.1615887,-0.99892735,-0.3229103,-0.18082145,-0.13190635,-0.75539416,-0.4400532,0.16710164,0.20924675,0.23815587,-0.22195236,0.99868137,-0.6028651,0.66961354,-0.1848417,-0.3140659,-0.49703264,-0.4938359,-0.07114341,-0.612249,-0.72032934,-0.43545645,0.99611044,0.31576928,-0.16555211,0.50273526,0.032691706,-0.15209197,-0.7689584,0.2920635,0.5612777,-0.8298289,0.5393866,-0.9996135,0.5694469,0.5858671,0.121704265,-0.3543148,0.40759632,-0.009685404,-0.2733189,0.017827453,0.016948896,-0.3240383,0.865683,-0.58905226,0.27908978,-0.26505738,-0.26337025,0.029641062,0.82269704,-0.89539677,0.63489103,-0.9486884,-0.42548826,0.03466042,-0.27154693,0.19032624,0.3203451,0.15157153,0.5573217,-0.31963918,0.33253384,-0.41661206,-0.1921731,0.38168675,0.30942482,-0.19440019,-0.9239936,-0.8160042,0.44260433,-0.106309146,0.4512968,-0.09904783,-0.9954994,-0.001762444,-0.08019448,-0.08319966,-0.24914716,0.085492134,0.6173292,-0.13662499,-0.5633507,0.1843859,0.1998262,0.083765276,0.18151541,0.2938397,0.40124232,0.4819079,0.6149559,0.4325781,0.29469895,-0.5826982,0.24689063,-0.13654675,-0.43782595,-0.22738837,-0.6645456,0.60076016,0.2556267,-0.33909813,-0.9986787,-0.3293132,-0.37092242,-0.219737,-0.64201474,-0.066049725,0.8207144,0.17399667,0.3433092,-0.67224675,-0.057174083,0.22532445,-0.4967949,0.09069057,-0.22854953,0.9645049,-0.20271549,-0.088047326,0.2376873,-0.49558112,-0.1555288,-0.3571911,0.10491138,0.70182276,-0.22041628,-0.090517245,0.14194408,0.100563794,0.43902677,-0.014618142,0.028406521,0.6559442,0.60085225,0.49150428,-0.5442083,0.05549505,-0.02395567,-0.394133,0.49911103,-0.021292403,0.30391285,0.15057673,-0.9981673,-0.15673865,0.47958046,-0.07676484,-0.35480908,-0.57848436,-0.26999974,0.65679365,-0.5379277,-0.7631009,0.10074149,-0.14834228,-0.38606754,0.5863038,0.061180204,0.20820005,0.7865661,0.49223673,-0.30618995,-0.4071147,0.7598499,0.7041183,0.21640132,-0.7916268,0.20950517,-0.10610051,-0.086338,0.08531713,-0.60647637,-0.22475755,0.99900866,-0.12438106,-0.31172016,0.12332622,-0.11924048,-0.48995683,-0.5351181,-0.97668415,-0.25786197,0.23297456,0.98843175,-0.34680995,0.8508857,0.11738953,-0.15959963,0.99963236,-0.8598458,-0.47454306,-0.4029398,-0.3342918,0.5224319,-0.62913835,0.09894054,-0.6036111,-0.24645087,-0.33079797,0.081096135,0.33407083,0.23942053,0.19299245,-0.38554546,-0.4521388,0.26726475,-0.7780269,0.6189729,0.32896498,0.40048447,0.8988277,0.2258067,0.06830473,-0.09184401,0.78638875,-0.7333743,-0.08058059,0.02344811,0.4816729,-0.9027616,-0.53311855,-0.16440517,-0.30987138,-0.26073158,-0.29803827,-0.05674838,0.14407139,-0.6017047,0.309127,0.44419077,-0.4657593,0.49600047,-0.25645113,0.53114825,-0.38380888,-0.07414131,-0.1852561,0.019068222,0.19041526,-0.4555496,-0.23471147,-0.45469368,-0.9623383,0.11553334,-0.15986788,-0.646959,-0.15202461,-0.3447071,0.27182823,0.9998163,-0.17105103,0.24363728,0.62647116,0.59566295,0.11621859,0.22998244,-0.4198736,0.28645182,0.13922164,-0.08979682,-0.17445405,-0.5418049,0.46798533,0.23089343,0.26619327,0.49679416,0.3810163,1,-0.330839,-0.7523832,-0.062564306,-0.3147173,-0.3420489,-0.3041938,-0.7668345,-0.026610596,0.6181496,-0.386001,0.53554994,0.30534267,0.18279341,0.7441056,0.042459045,-0.05474722,0.09301022,0.52761704,-0.046483494,-0.85462797,0.2132435,0.34373146,0.34980887,0.15559861,0.84124863,0.24711268,0.09242503,-0.5554118,0.35261986,-0.34463564,0.023028335,0.9474701,-0.22484756,-0.6505395,0.32074177,0.278191,-0.47744086,0.7078339,0.10564761,0.39185336,0.963128,-0.40496203,-0.9689764,0.29943758,0.99989307,-0.7275571,-0.106591016,-0.97993296,-0.61359584,0.30889344,0.6687728,-0.22973369,-0.7544448,-0.25309154,-0.16062127,0.10381854,-0.026546651,0.072332196,-0.18851762,-0.33519796,-0.1718194,-0.53973025,-0.9999895,-0.9970648,-0.8948743,0.14381853,0.3497811,-0.33400983,-0.43277887,-0.6253425,-0.88238686,-0.60758203,-0.7710073,0.71185046,-0.82784164,0.59136504,0.18593052,0.27356523,0.2539077,-0.29250225,0.28435338,-0.35267758,-0.99996835,0.040886417,0.14876378,-0.55802566,-0.3509062,-0.060831513,-0.046430733,0.7068213,-0.30976984,-0.17789744,-0.5936465,0.040815827,0.6684364,0.95513344,-0.012268158,0.8186203,-0.5324435,-0.43960693,-0.1678766,-0.40161386,0.109014146,-0.48036104,-0.71058637,0.107128024,0.52222437,-0.4332723,-0.2988853,0.4057282,-0.3539827,-0.6624388,0.3725401,0.62829816,-0.7251265,-0.15707156,0.12699103,0.93286157,0.5240924,-0.101892,-0.3352329,0.25660053,0.29790813,0.9998823,0.07287414,0.46139225,-0.68234706,0.08489636,-0.7043203,-0.17431319,-0.9616631,0.006255291,-0.7529119,0.4074447,0.65137887,-0.5388138],
    [137,1,"O=C(O)C1(C(=O)Nc2ccc(Cl)cc2Cl)CC1",-0.648094,-0.3072527,-0.7472601,0.432826,0.12826991,-0.55364937,-0.3764688,-0.110979974,0.526958,-0.18625993,-0.57512957,-0.31211647,-0.3332907,-0.27679893,0.35455576,-0.359455,0.15205117,0.15092982,0.38871145,0.27671337,0.46112508,-0.44872436,-0.035434686,-0.41925514,-0.019146135,0.17761108,0.35294545,0.052083574,0.4944955,-0.21543936,-0.15756048,0.5449505,-0.104414016,-0.29522958,0.38906553,-0.39503032,-0.62443054,0.058736093,0.9683551,-0.58807737,-0.9913195,0.30276477,-0.3431575,-0.04228074,0.9138059,-0.9796871,-0.24232401,-0.20398279,0.44174168,0.08700921,-0.2749326,0.655517,0.0818813,0.15754028,-0.58124465,0.1939407,-0.65991765,0.52799773,0.061962362,0.09274932,0.018774172,-0.59508634,0.261179,0.25362906,0.029755691,0.39304438,0.4718805,0.18811968,-0.5035187,-0.09425519,-0.9407559,-0.96913004,0.2791941,0.21430704,0.44175935,0.17059498,-0.31176904,-0.44931394,0.5869204,-0.9990442,-0.7829534,0.09157522,-0.7049038,0.15182075,0.2759736,-0.46399587,0.5614713,0.19560163,0.063260935,-0.40822178,-0.410771,0.6657655,0.16055389,0.2698479,0.99409056,0.093079664,-0.089457564,0.260045,0.49310493,0.18782084,0.08819359,0.13357347,0.770551,0.8945113,-0.41498253,-0.22816448,-0.23710169,-0.11403993,-0.999452,-0.37152094,-0.39234278,-0.21328586,-0.21610233,-0.468146,0.004479143,0.45567366,0.1089409,0.1319156,0.99886113,-0.2690498,0.03822015,0.073298424,-0.84082866,-0.547596,-0.8287021,-0.17831141,-0.004509804,0.3699144,0.15706286,0.9993959,0.08340964,0.17223775,0.55890423,0.028916705,-0.45091444,-0.8685182,0.24017581,0.5482304,-0.56735003,0.5218618,-0.9999908,-0.4709456,0.8758898,-0.28778794,0.33154264,0.12460707,0.110535026,-0.2884475,0.84748757,-0.32868624,-0.21946551,0.5984308,0.32008386,0.5864587,-0.17114429,0.05981339,-0.37355816,0.96992993,-0.5307129,0.47833756,-0.96469724,-0.039708853,-0.25910723,0.19773428,0.25434625,0.6226941,-0.6742221,0.05064749,-0.38419595,0.68211514,-0.45136285,-0.000237564,-0.208997,-0.33980328,0.42462388,-0.96436125,0.49155408,-0.045275535,0.47975424,0.020699058,0.11823667,-0.9451762,-0.26259905,-0.15635183,-0.62955827,-0.37695315,0.097203165,0.41516262,-0.07758821,0.30331805,-0.1378606,-0.4881822,0.19012456,-0.50593,-0.33437324,-0.60213566,0.3140035,-0.36581114,-0.18824787,0.60287386,-0.19122444,-0.6035019,-0.5618442,-0.05529856,0.2674458,0.15924336,-0.024987847,0.37960634,0.23076946,-0.99902534,0.27739373,0.2840135,0.013774586,-0.8183912,-0.16399598,0.53241205,-0.20024404,-0.3900393,0.2474133,-0.56925124,0.46082836,-0.36386108,-0.7132673,0.23674957,0.992516,-0.40331516,-0.1361474,0.5989465,-0.23398429,0.12854277,-0.25520954,0.3241269,0.033085737,-0.11147895,0.2531845,-0.48977816,0.29052186,-0.1801538,-0.21794437,0.058486704,0.8647284,0.113876425,0.48993966,-0.5939803,0.11927484,0.010172806,0.2383937,-0.11135623,-0.15442201,0.03346142,0.6058499,-0.97082984,-0.37279585,0.4160735,0.17821313,-0.2600162,0.1816025,0.44400063,0.21428382,-0.40059507,-0.109965794,0.24078089,0.6968082,-0.3158259,0.6371779,0.15215379,-0.03937572,0.29099873,0.55064595,-0.059459805,-0.03782641,0.41433537,0.060996335,-0.12948027,-0.4330238,0.8504246,-0.32054722,-0.64939666,0.48652464,0.06257998,0.28342503,0.9995732,-0.07125916,0.49358332,0.64557785,-0.37828103,0.1295528,-0.85829145,-0.8941494,0.4468223,0.18148614,0.99683064,0.48107967,0.077624746,0.4250343,-0.14769307,0.99998933,-0.94420815,-0.15168136,0.35273933,0.086999595,0.003253772,-0.2986911,0.8406658,-0.44071093,-0.120471194,0.45913488,-0.19645631,0.67022735,0.056677207,0.52634174,-0.3119478,-0.42356738,0.37237903,-0.15242942,-0.6520483,-0.29118973,-0.20532101,0.95345384,-0.6754673,-0.6641133,-0.062030584,0.20423089,-0.37602815,-0.31545883,0.1290192,0.57926905,-0.97966295,0.32415438,-0.1585326,-0.254451,-0.68759614,-0.47181824,-0.19621591,0.8082872,-0.34374434,0.5682835,0.08772044,-0.40643305,0.7016019,0.2858633,-0.37116092,-0.076298594,0.5509659,-0.34192413,-0.38382986,-0.6098256,0.015754338,-0.6295235,0.005344861,-0.9929872,0.19265677,0.41357034,-0.41607904,0.06415701,0.1251051,-0.33323538,0.9989298,0.20413682,-0.33025113,0.1269484,-0.21683428,0.24061503,-0.19543035,-0.60485786,0.14063515,0.31919694,0.005741346,0.23969883,0.06585679,-0.45486736,0.40720642,0.08558441,0.78258306,0.37085336,0.9937079,0.6558703,-0.6747518,0.7399325,-0.47145322,-0.41688433,-0.19305989,-0.5201651,-0.028138805,-0.124716274,0.31156737,0.08781288,0.2692206,0.20454048,-0.053011138,-0.18743877,0.30597886,-0.049947385,-0.11330148,0.7193033,-0.100350484,-0.36750782,0.23882835,-0.25205278,0.22962573,0.30857602,-0.27517974,0.041946135,0.6175103,0.46310475,0.16581243,-0.66694134,0.000493747,-0.095346056,-0.17265646,0.28676963,0.44839254,0.3962484,0.41360292,0.051533174,-0.12835021,0.9381584,0.11827202,-0.9903492,-0.0527291,0.9998243,-0.6194354,-0.10770609,-0.96863043,-0.12311079,0.38098103,0.31152517,-0.77102816,0.11169646,-0.25297487,0.21807557,-0.100232325,-0.013288082,0.42204952,-0.233213,-0.41210416,0.25597155,-0.5485655,-0.99999356,0.99883693,-0.918511,0.30254763,0.2371305,-0.21982059,0.20895554,-0.5547741,-0.8699766,-0.12518647,-0.8176875,0.38135457,-0.6532338,0.3138858,-0.2697199,0.52631795,-0.33644572,0.033669956,0.35812172,-0.7614837,-0.9999694,-0.35449198,-0.5572495,0.06237414,0.060908284,0.30071098,-0.8807584,0.34378958,0.3516905,0.6596264,0.011435673,0.1420155,0.6339536,0.8202873,-0.33069494,0.88901824,0.32372656,-0.5987228,0.3345112,-0.69119865,-0.5873857,-0.23838401,-0.3981361,-0.30303407,0.8591881,0.44893748,-0.16458878,0.2224736,-0.003728249,-0.055017658,0.25133353,-0.058326866,0.06543845,-0.32481015,0.012411262,0.8426874,0.09803356,0.45391998,-0.16659194,-0.43025523,0.5254453,0.9996883,0.6159664,0.15797693,0.29989374,-0.5129903,0.14275129,-0.033666972,-0.8881265,-0.62150735,0.15741727,0.5412847,0.51525223,0.006193849],
    [138,1,"CCSC(=O)N(CC)C1CCCCC1",0.07042776,0.37334177,-0.25679564,-0.2727243,0.37960446,-0.20966901,-0.585476,0.5065281,-0.54839253,0.061931532,-0.501056,-0.3242236,-0.26446143,0.003617185,0.29052266,0.23108676,-0.3300017,0.019588772,0.4577245,-0.44602495,0.3798176,-0.33353335,0.01539258,-0.30557668,-0.09739988,0.26782474,-0.29618874,0.009981999,-0.028537182,-0.19667245,0.3433165,0.3771567,-0.09626791,-0.18577836,-0.17168678,-0.5615535,0.5036135,0.17368549,0.5533926,-0.8471077,-0.98955923,-0.69949335,-0.67574215,0.6575735,-0.11141866,-0.98754454,0.0951477,0.49240798,0.9599703,0.27465782,0.33511856,0.038894422,-0.13973548,0.36422983,-0.83149636,0.27830392,0.106448956,0.91999406,-0.004494074,-0.042038683,0.040107775,-0.08599977,0.086801335,-0.1552725,0.15017891,0.2704971,-0.28033328,0.38404885,0.036365483,0.29285407,-0.16843201,-0.9319625,0.033007573,0.83142656,0.48389193,-0.10521937,-0.14124738,0.1801991,0.44552234,-0.9997972,-0.04006408,-0.17458954,-0.07972061,-7.72e-05,-0.05753878,-0.27045333,0.63335615,0.4062178,-0.3306315,0.28531152,0.62376964,0.31275943,-0.006322225,0.15282594,0.9475947,-0.29639736,0.4335583,0.43025205,0.08689183,-0.050274234,0.14857227,-0.24830562,-0.09288412,0.49979514,0.56928915,0.02742769,0.36911744,-0.06452798,0.98844403,0.22177239,-0.14418146,0.35761133,-0.46167648,0.17036904,-0.6056222,0.13006565,0.2750792,0.56845725,0.9988283,-0.28691807,-0.6356317,0.4906913,0.29518083,0.30109212,-0.101974726,0.44688755,0.05337534,0.46981716,-0.007841779,0.99947965,0.5462221,0.59477854,-0.39419228,-0.6057932,0.43790284,-0.97636503,-0.20113929,0.19109268,-0.3161134,-0.7564137,-0.9961957,-0.04872798,0.984141,-0.09983905,-0.14854306,-0.35839978,-0.3691908,0.1392263,0.9645819,-0.07630991,-0.43754816,-0.4275225,0.45184597,0.6106427,-0.5100167,-0.25957128,0.099775866,0.9968757,-0.5387199,-0.8997445,-0.980666,-0.41779757,-0.50550854,0.07046642,-0.65432745,0.19453266,0.20906107,-0.70205194,-0.21453886,0.015347957,-0.006197202,-0.50129974,0.12291233,0.58915687,-0.37269035,-0.9296301,0.8824682,0.063842274,-0.0992114,-0.26016316,0.33599684,-0.20070276,0.07921395,0.51536655,-0.86617154,-0.40321046,0.14578906,0.49671245,-0.15624037,0.22170313,-0.71430117,-0.5289244,0.5689544,0.6539086,-0.41105694,-0.43624347,0.35366943,-0.84516317,0.62507784,0.4844742,0.32821336,-0.5302582,-0.07273609,-0.6191555,-0.29217556,0.24870172,-0.12580816,-0.18728934,0.066095956,-0.99493307,0.043064024,-0.11658147,-0.20467383,-0.105577916,0.25412986,-0.5689836,-0.5116112,-0.71295583,-0.52459,0.09768039,0.15554753,-0.1809949,-0.44644114,0.08651774,-0.9449312,0.19628394,0.44869485,-0.014133997,-0.0828788,-0.04031684,-0.52854276,-0.589696,0.024276981,-0.5680074,0.017318243,0.15787868,0.11065155,0.20308055,0.020340078,0.41724384,0.78849274,0.2022461,0.48722938,-0.1441955,-0.4506189,-0.42722622,0.61214244,-0.70729,-0.64199555,-0.2918861,0.6117116,-0.9979857,-0.41407004,0.18287963,-0.34468606,0.62985474,-0.79156816,0.09268542,-0.23836206,-0.5550196,-0.28676295,-0.32666776,0.20348713,-0.31029952,0.022557758,-0.045799002,-0.13464805,0.33499303,0.6789717,-0.10035103,-0.007549343,0.8680487,0.002343665,0.28366497,0.15024304,-0.7133916,0.5600584,-0.79273003,-0.8215606,0.5813034,0.27811572,0.9990863,-0.40108493,-0.40374175,-0.74554014,-0.1430573,0.4580418,0.87823933,0.97562486,-0.388246,-0.3356836,0.9989447,-0.3137494,0.6233203,0.13599348,-0.7587539,0.9980695,-0.97782546,-0.12717634,0.32228172,-0.18719617,0.46529865,0.40711662,-0.26593494,-0.16502964,0.07293122,0.9724939,0.27578244,0.62632895,0.5160413,-0.23794787,-0.3329772,0.2266755,-0.28660488,0.7368008,0.057337902,-0.32738483,-0.03763131,-0.9999715,-0.37585464,-0.31502256,0.5675612,0.15892047,-0.5567912,0.30201703,-0.17383009,0.07496955,-0.9542184,-0.20791735,0.1072629,-0.20206259,0.001677228,-0.028601335,0.15021843,-0.26218557,0.39375702,-0.18274991,-0.8347616,0.5137949,-0.38831723,0.20231195,0.7764474,0.3644443,0.87918496,0.38107297,-0.14793013,-0.17000915,0.43452114,-0.1864648,0.7734523,-0.9929875,-0.5245554,0.70612603,0.096265346,0.14854695,-0.19235319,-0.15210062,0.9995607,-0.81704617,-0.3240413,-0.09806379,-0.07024856,-0.265038,-0.06171064,-0.5970878,-0.60036916,-0.23066589,-0.28815898,-0.6999607,0.5181932,-0.35959774,-0.23411345,-0.48505524,0.7930081,-0.18179914,1,-0.03753272,0.38144484,0.5059205,0.08727789,-0.45792064,0.3168553,-0.07639518,0.4029431,0.7353218,0.14933814,0.2634423,0.8397882,0.16588569,-0.24429812,-0.4315918,-0.1029604,0.30619678,-0.4429502,0.47962984,-0.57769895,-0.08706094,-0.6203714,0.47485363,-0.33119312,-0.8094136,-0.04653482,0.03854765,0.17480142,0.14038558,-0.015992505,-0.04863875,-0.35452566,-0.043123383,-0.24958727,0.07560368,0.4376701,0.32015726,0.38017416,0.28619763,0.11879672,0.9999999,-0.2583081,-0.7707915,0.06865915,0.9985353,0.32079542,-0.56012535,-0.99996483,-0.082664624,-0.30671817,0.33744502,-0.24003056,-0.40453088,0.49153444,-0.3490106,-0.35383326,0.27493772,0.34507206,-0.33155066,0.6549736,0.52719456,0.3128977,-0.99980265,-0.99896425,-0.9837327,0.16736452,0.6063908,-0.097913,-0.71141875,0.07858667,-0.493231,0.30678436,0.16027467,-0.14595425,0.44226763,-0.31112817,0.26256564,-0.44305104,0.546487,0.12674266,0.11456608,-0.944709,-0.9997754,-0.4836442,0.58019114,-0.25322676,0.4830985,-0.11398084,-0.9842757,-0.50774425,0.011263225,-0.25965285,-0.4339663,-0.46042585,0.1571807,0.7166063,-0.05913388,0.6856554,0.4475746,0.35926816,-0.10399549,-0.25773138,-0.42418784,-0.092511885,-0.46354693,-0.40563205,-0.4064358,-0.37809485,-0.03108012,0.011000176,-0.32145762,-0.24582766,0.26467007,-0.7755686,0.121760644,-0.062168095,0.3476926,-0.27272028,0.246508,-0.51663435,0.29191944,-0.2837994,-0.025486086,0.99952054,0.118544996,-0.25121132,0.20609114,0.5192311,0.5204752,-0.66536176,-0.76078874,0.02827578,0.20281981,0.058407772,0.48163125,0.2755931],
    [139,1,"Cc1cc2c(cc1C(F)(F)F)N(C(=O)Nc1ccc(Oc3cccnc3C)nc1)CC2",-0.84315825,-0.14135821,0.15600869,-0.4653262,0.005658432,0.30184415,-0.7366465,0.32404688,0.47909358,-0.2899873,-0.58222026,-0.32473603,0.4753611,0.54961896,-0.22594775,-0.79145217,-0.6369771,0.01268034,0.51849765,-0.07793958,0.3923932,0.5749713,-0.27317756,-0.26472634,0.33447465,0.11072391,0.7425671,-0.50266194,-0.38477945,-0.3359679,-0.67967975,0.2490331,-0.24771595,0.09372815,-0.16620685,0.57466316,0.08693833,0.6320407,0.9995286,-0.35473394,-0.30244264,-0.51488787,-0.86886185,0.7663909,0.7776886,0.83296883,0.42599684,0.21684484,-0.53672004,-0.3894859,0.71508735,0.35142365,-0.31097516,0.36592174,0.31471482,0.45163557,-0.6564336,-0.904001,0.59171534,-0.4606802,-0.5323408,-0.62300044,0.022978848,0.24584511,0.08504024,0.64575136,0.18794551,0.23567039,-0.8027321,0.19470634,-0.98229337,-0.41844067,-0.49781218,-0.69113797,0.14080128,-0.19736573,0.17940445,-0.28684255,0.21009359,-0.99909127,0.3018488,0.26547506,-0.9521998,0.31593737,0.01724672,-0.98515314,-0.23475252,0.2992697,0.18723345,-0.29255113,-0.09929356,-0.33066043,0.2573143,0.24828637,0.998874,-0.025519162,0.81151086,-0.5165204,0.08919264,0.002276175,0.004488391,-0.8133908,0.012650971,0.9905446,-0.9996488,-0.6252983,-0.07483303,-0.6114072,-0.9509259,-0.38049603,-0.77970773,-0.28592625,-0.30048224,0.2665617,0.71515375,0.7128968,-0.118811585,0.8291029,0.6012988,0.24917512,0.5207181,0.012726611,-0.17692614,0.215503,-0.81487626,-0.7129722,-0.19375601,-0.690966,0.0751806,0.9997351,-0.37091604,0.14060071,-0.27463272,-0.35320863,-0.46792397,-0.99814045,0.39473826,0.64171886,-0.18342002,-0.72794574,-1,-0.46123528,0.23912506,-0.3154948,-0.045743488,0.41883117,0.005977981,-0.37443042,-0.9978975,0.11403133,-0.05507015,0.8880435,0.31335348,0.14147751,0.19271629,0.2591479,-0.26303834,-0.96086663,-0.69968414,0.4249055,0.40691927,-0.7253264,-0.5033189,0.81989443,0.07123606,-0.5013554,-0.72083205,-0.70063436,0.46492028,0.05870237,0.27235064,-0.09219046,0.2273065,-0.45311806,-0.32581046,-0.8775843,-0.26378497,-0.783121,0.111194335,0.23521364,-0.6154204,-0.39278802,-0.4161092,-0.0430714,0.49807438,0.704234,0.370528,0.41950542,0.42874327,-0.22387083,0.14458452,0.5855924,-0.3111689,0.42000574,-0.16663666,-0.2025362,0.118041806,-0.84822595,0.32853752,0.03888756,0.6890916,-0.2995183,-0.23663339,-0.42572773,-0.106441654,0.24376734,-0.11938831,-0.65994996,0.6169235,-0.999964,-0.04956803,-0.19327503,-0.2845863,-0.008086205,-0.21646827,-0.09506375,-0.016826903,-0.22462964,-0.6742033,0.093449906,0.37300268,-0.39143926,-0.3870983,0.43173668,-0.964977,-0.47403696,0.032364048,0.76346385,0.042945284,0.489962,-0.0556572,0.4059749,-0.20120007,-0.33418906,-0.56363016,-0.20313911,-0.3421416,-0.6186642,0.46651933,0.3366781,0.85958886,-0.18080221,0.18817233,-0.71550715,0.5455615,-0.36181298,0.84036297,0.35937333,-0.25377902,0.12307925,0.7781183,0.067622386,-0.2074227,0.6477338,-0.21453947,0.5336819,-0.1398954,0.2287396,0.66362303,0.3271843,-0.11889386,0.14006487,-0.06621617,0.19522782,0.6639709,0.29729417,-0.3941695,0.19627653,0.8017991,0.13326906,0.34814063,0.99891293,-0.032382663,-0.73684883,-0.1616089,-0.004930158,0.14579348,-0.5146308,-0.53900105,-0.42612073,-0.3606066,0.95675284,-0.5541796,0.78596836,-0.19482276,-0.13163383,-0.16684003,0.8103558,-0.46557087,0.56775355,-0.80028534,-0.50880814,0.8225133,-0.46896428,0.5200816,0.13752298,0.9999998,-0.99499315,0.59866965,0.703695,-0.48835984,-0.5594576,-0.5683243,-0.048958104,0.42117333,-0.10731426,-0.9991692,0.77724445,0.9338889,-0.10088992,0.20357828,-0.4596659,-0.77522737,0.0757587,0.8139166,0.23808719,0.16083495,0.48891926,-0.9503036,-0.28863806,-0.06701453,0.25552306,-0.40639755,-0.51926726,-0.47194552,0.81274575,0.12474878,-0.92534095,-0.5471195,-0.057018198,-0.21900965,-0.06727643,-0.7067947,0.001676491,-0.17951949,0.850563,0.8226101,-0.3206602,-0.40812638,-0.15823488,-0.039290316,0.20597647,0.50581264,0.19907561,0.45926583,-0.1526006,-0.31385008,-0.68988466,0.1892635,-0.9869256,-0.4877926,0.32594508,-0.31322905,0.03229778,-0.3320639,0.7381809,0.37965018,0.99983084,-0.22006074,-0.83619195,-0.12503569,-0.27375343,0.06807291,-0.8167826,-0.8149786,0.37229937,0.28277144,-0.2708544,0.40230384,-0.344746,0.48055336,-0.23795335,-0.1403998,-0.56537616,0.10884266,-0.9999998,-0.7569277,-0.42251915,0.060940217,-0.29181886,0.60242516,-0.66765773,-0.5853941,0.23014958,-0.6352791,-0.26968932,0.25663733,0.85709184,0.10748883,-0.51144046,-0.37389475,0.37070316,-0.003670409,0.17905697,0.5702245,0.7459934,-0.49511233,-0.14534234,-0.6023163,-0.55758333,0.934319,0.3796527,0.25370625,-0.20281336,0.7450401,-0.60817724,0.24830973,-0.5479464,0.5152713,-0.31732005,0.48921007,-0.14547527,0.52634573,0.097839735,0.40688166,-0.1555617,0.9998382,0.81324583,-0.96288735,0.021184532,0.99963367,-0.48945785,0.08051224,-0.99887556,-0.4051797,-0.9290296,0.3273991,0.04293979,0.2048193,0.27185825,-0.23435758,-0.7841356,0.11098258,0.41518956,-0.66159165,-0.32519284,0.35424107,-0.24311653,-0.99988663,1,0.920574,0.71771526,-0.3600438,-0.71139026,0.31912684,0.027705936,-0.6755476,-0.41705868,-0.13050875,-0.47692987,-0.8051624,0.7745401,-0.81147563,0.08388043,0.63279146,0.53741693,-0.18391886,0.9815824,-0.9978178,0.3610129,-0.26644462,-0.5087821,0.4196331,-0.82941085,-0.8720639,0.48092777,0.1972343,0.51474893,-0.15928118,-0.16939132,-0.5298728,0.9895726,-0.03626451,0.9394801,-0.019749047,0.20113991,-0.48124334,-0.0840172,-0.2362787,-0.30122167,0.3194879,-0.5204027,-0.60925937,0.39467418,-0.14763744,0.863564,0.084965274,0.20618086,0.34515148,0.5368627,0.44588903,-0.18344514,-0.491592,0.9995074,-0.23130769,0.2499537,0.10080963,0.11204926,0.21519785,0.99956584,0.49183112,-0.2885406,0.14297,-0.60986894,-0.019087877,0.7258289,-0.99918795,0.06033828,-0.47503796,0.43285784,0.048002873,0.021532452],
    [140,1,"C=CCOC(Cn1ccnc1)c1ccc(Cl)cc1Cl",-0.24245492,-0.5711731,0.46568933,-0.13063248,0.2877046,-0.14542502,-0.4150934,-0.28673604,-0.0534293,-0.26429746,-0.09453894,-0.4539126,0.24914011,-0.3030088,-0.023122415,-0.10901492,0.5547384,-0.22062202,-0.026266137,0.40824163,-0.053321913,-0.335863,-0.76726156,0.072611354,-0.26719692,0.29560146,0.15301237,-0.13648531,0.35459617,0.054464705,0.49431148,-0.20753004,0.6667438,0.15397464,-0.52004987,0.08853274,0.29531863,0.16166566,0.98708576,-0.88140535,-0.82582754,0.5879307,0.1919864,0.32599196,-0.64025724,-0.896433,-0.38581988,-0.11783605,0.92508394,0.31951097,0.6292483,0.3240342,-0.21821387,0.03658376,-0.7630829,0.57544667,-0.2726229,0.60603034,0.37061498,0.3163553,0.28426737,0.39150533,-0.086095534,0.25942564,-0.5260502,0.027936041,-0.30311096,0.11344592,-0.16236751,-0.5872608,-0.6700825,-0.84321344,0.44696522,-0.28698146,0.85485405,-0.5858549,-0.38529152,0.25854683,-0.76541823,-0.9990165,0.5449819,0.015220352,-0.94910604,-0.35275573,0.07612419,-0.7633719,-0.0253209,0.53506714,-0.43718445,0.35650787,0.22359517,0.5113685,-0.370108,0.44848585,0.9784374,-0.07424426,0.7450249,-0.5913655,-0.6168961,0.022186492,-0.1999553,-0.1828109,-0.058607128,0.87734425,-0.810062,-0.68747354,0.029680913,0.50442445,0.9816118,0.12835202,0.67169726,-0.21720816,0.056827787,-0.19404443,0.13376221,0.3548491,-0.36460006,0.61427593,0.996203,0.019757692,-0.5301758,-0.48381156,0.071234226,0.26460737,-0.47603947,0.28011796,0.3145432,-0.18379878,0.48896125,0.99972767,0.5472202,-0.3507009,0.12236041,0.25331894,-0.12216066,-0.9925784,-0.16839357,-0.14660954,-0.15169753,-0.64862764,-0.99987495,-0.6564979,0.9725497,0.60356414,0.76299757,0.6999964,-0.012293401,-0.28939664,0.26318908,-0.13912272,-0.17093626,-0.84535,0.38957593,0.22955462,-0.4321709,0.47637105,0.50890845,0.9452808,-0.39189413,-0.8775455,-0.9497575,-0.43962914,-0.40057445,-0.22604772,0.23535419,0.6157776,-0.2893452,-0.004606117,0.07976504,-0.107061245,0.34149545,0.32474,-0.3998356,-0.37224317,0.38462213,-0.6807732,-0.58831424,0.41533667,-0.4920707,0.30688626,0.14632149,0.06977991,-0.010178936,-0.12612641,-0.43409717,-0.40626392,0.033422157,0.24523513,-0.5512883,0.089054264,-0.54984635,-0.6112362,-0.29968685,-0.019440128,0.23256747,-0.000319537,0.7445286,-0.75482106,0.7203718,0.7020099,-0.3349849,-0.30425394,-0.30180013,0.13126032,0.099916995,-0.029802574,0.49277607,-0.078288585,-0.1456275,-0.9996187,-0.38913518,0.27935597,-0.046653572,0.49335757,-0.4586469,-0.04242276,0.13681807,-0.29329464,-0.5591811,-0.11143463,-0.2654458,-0.16763319,0.13313898,-0.2726871,-0.97732574,0.03878034,-0.042882275,0.19402488,0.004042597,0.3281725,0.12884712,-0.6012916,0.4334327,0.30478752,0.54802805,-0.11437012,-0.37306237,-0.17180142,-0.20771025,0.15898387,0.9128601,-0.22858311,0.23038016,-0.4196127,0.717559,-0.6655297,-0.03963203,-0.3542491,0.44414914,0.37762251,0.06560926,-0.97118807,0.017774984,-0.37861794,0.055204183,-0.26681253,0.83897156,-0.19542862,-0.56789005,-0.11251411,0.19369717,-0.4017207,-0.034256294,0.124099486,0.041814674,-0.4836187,-0.03705726,0.024878776,0.76391524,-0.12216243,0.2994968,0.9884615,-0.16915599,-0.4569662,-0.5414082,-0.49062786,-0.006672398,-0.64929545,0.13671933,0.33533353,0.5625577,0.9987635,0.43310413,0.30960757,-0.5375315,0.32595235,0.58345205,0.82970655,0.9645684,0.08511786,0.2830712,0.994219,-0.45433784,0.6601481,-0.29652444,-0.89574057,0.99996877,-0.9900602,-0.51440215,-0.28503713,-0.25170308,0.42154992,-0.087395154,-0.016213696,0.6329545,-0.5426725,-0.10657888,-0.05897676,0.5892543,0.1908134,-0.25444025,0.17263752,-0.4182641,-0.20970696,0.8261435,-0.7631957,0.10028832,-0.22907224,-0.9999114,-0.38284105,0.24342296,0.24930151,0.36152858,-0.5228789,-0.036019575,-0.18092944,0.44319397,-0.72039133,0.9117427,-0.19859158,-0.6082079,-0.5986067,-0.15945056,-0.09894781,0.17202719,0.4734454,0.08815268,0.8074856,-0.3980118,0.3989017,0.4761977,-0.6047731,0.3467699,0.65045655,0.728731,-0.3299873,-0.67775375,0.5947845,-0.68695015,0.19463418,-0.98404473,0.095853835,0.35030112,0.04340551,0.432141,0.21223567,0.54552174,0.99976075,-0.09118374,0.14367431,-0.37560457,0.12222194,0.5219174,0.44296995,-0.75784546,-0.09052509,0.552396,-0.4416833,0.000541764,-0.4436348,-0.583742,0.4361125,-0.20203152,0.104095004,0.025053808,0.99636763,0.112433404,0.19631864,-0.07423291,0.68787456,-0.2363321,-0.23882994,0.08539985,-0.4097969,0.12953013,0.14554097,0.38011208,-0.18807067,-0.16089213,0.3748554,0.004675522,0.57396036,-0.20726113,-0.45382857,0.097484335,-0.5497251,0.043119725,-0.81475794,0.17987236,-0.5096311,-0.5936689,0.21803595,0.5142078,0.6489552,-0.156512,-0.015136137,-0.764692,-0.46095872,0.6044762,0.5741002,0.041046523,0.28483993,0.6336123,0.11916274,0.17994182,0.36166635,0.9999998,-0.15012912,-0.9365974,0.09892752,0.99919057,-0.7455217,0.19374922,-0.99993485,0.5668215,-0.42220125,0.058050882,-0.5788615,0.05842284,-0.17198303,-0.26721004,-0.20101506,0.06044657,0.52894074,-0.131494,0.06794367,-0.15913513,-0.3179021,-0.9999578,0.9947459,-0.8504578,-0.03057011,-0.13970052,-0.3334742,0.526496,-0.6612971,-0.41800335,-0.39108723,0.6043935,0.4347019,-0.59210956,0.1807163,-0.36923012,0.30397987,-0.3835895,0.18925707,-0.46817774,-0.46295303,-0.99977314,0.36106825,-0.6604018,-0.32541355,0.20163405,0.635313,-0.9718836,-0.44576308,0.12224837,-0.08141303,-0.09016645,-0.1948388,0.5223523,0.9559606,-0.027305517,0.6244946,-0.10972273,0.52016735,0.045232978,-0.37026772,-0.6838711,-0.57403857,-0.054029763,-0.41572076,-0.19925684,0.65494204,-0.20218816,0.0628543,0.08368564,-0.5362268,-0.10853416,0.3836993,-0.3884512,-0.19760714,0.5910947,0.94805545,-0.29506528,-0.3300859,-0.4199009,-0.16819027,0.46983024,0.9999187,0.49473158,0.12298565,-0.22585048,0.111398414,0.37339118,0.3407558,-0.9660041,-0.15181065,0.42428082,0.0327591,-0.41647536,0.7090574],
    [141,1,"Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl",-0.5451156,-0.20096534,-0.18604954,0.724184,-0.29111674,-0.2893367,-0.47901675,0.15717857,-0.043904517,-0.23759699,-0.79425466,-0.03261032,-0.3108367,-0.36228243,0.22595654,-0.8730283,-0.4443929,-0.13091722,-0.19492725,-0.43780604,0.5760636,-0.62385005,0.7579706,0.2944122,0.24947503,0.5112689,0.1354557,0.10765874,0.8379479,-0.607406,-0.14103752,0.87586206,-0.34515673,0.20901455,-0.27852798,0.15966836,0.176903,0.049813136,0.77624387,-0.93227947,-0.98884577,-0.173343,0.20146291,-0.39868978,0.46465853,-0.990993,0.33573306,-0.3321241,0.98254645,-0.17718817,-0.31173047,0.58527905,-0.019040948,-0.059528604,-0.96316403,-0.034254406,-0.8947355,0.8018104,-0.3585859,0.68701017,0.52681214,-0.04374963,0.061964072,0.36338457,0.11711518,0.75352544,0.4152213,0.28952706,0.22325982,0.10276862,0.6736342,-0.2461657,0.007083387,-0.5322764,0.9039998,-0.78078735,0.5917346,-0.32388663,-0.2532425,-0.97403634,-0.8253179,-0.5840582,-0.7742836,0.3921702,0.21118952,-0.5556244,0.2449668,0.23689112,-0.37790555,-0.11148223,0.3927452,0.21607277,0.5931504,0.3853324,0.05551047,0.07188484,0.59809434,0.29561806,0.6018028,-0.6392846,0.78373873,-0.55920273,0.81165785,-0.9152118,0.6460047,-0.10126161,-0.22062469,-0.010043983,-0.846872,0.7087146,-0.80636483,-0.09716197,-0.44660434,-0.42587408,0.32776052,0.46276796,0.4566812,0.6482758,0.9995718,-0.6983968,0.32084113,0.35032496,-0.088118,-0.22276692,-0.5427401,0.1454967,0.55243707,0.21121672,-0.4693369,0.99970806,-0.2620837,-0.42459646,0.75864756,-0.40460435,0.52353585,-0.5677494,0.8388621,0.57479787,-0.775116,-0.33027494,-0.9977182,0.4335881,0.9978733,0.38129795,-0.33633378,-0.23027198,0.35914534,0.057941727,0.97588885,-0.80071145,-0.053608682,-0.5724152,-0.261379,-0.06820904,-0.30362824,-0.5273105,-0.322202,0.99817765,-0.91358286,-0.6270375,-0.9790982,-0.586487,0.2196274,0.13367374,0.8823323,0.5699158,0.13300763,-0.7945679,-0.14460829,0.0788608,-0.93767315,-0.3937859,-0.25815952,0.040518582,0.26421162,-0.8560907,-0.95686424,0.6204198,0.10403332,0.63257194,0.42326188,0.71634454,-0.4603957,-0.22988582,-0.6717995,-0.6200067,0.6869205,0.72607464,-0.5489986,-0.46445906,0.9322949,0.32609034,-0.09218229,0.34003595,-0.42913112,0.000176456,0.692942,0.05510704,-0.007186138,0.69841796,-0.73803395,0.7465259,-0.7909183,-0.81041604,0.02310939,-0.698384,0.5456712,0.4789931,0.31711537,-0.9766589,-0.049417354,0.42592072,-0.14655295,0.30462867,-0.17145774,-0.5076016,0.4597476,-0.3032036,-0.59127265,-0.27655095,0.03799936,-0.7384076,-0.343212,0.21063896,0.9747712,-0.40161353,0.45467883,0.744179,0.14509453,-0.22881673,-0.42098027,-0.3621864,0.003925296,-0.6704967,0.38387263,-0.44576716,0.19412522,0.27696562,-0.77672434,0.3016051,0.8721027,0.746204,0.559317,-0.6668711,0.49900588,-0.021450149,0.5727637,-0.395226,-0.15036851,-0.8627434,-0.2773758,-0.9987997,-0.38074037,0.1383036,-0.7739219,-0.5877957,0.5191626,-0.046144508,-0.41089022,0.25804913,-0.42655155,0.68986857,0.7650844,-0.8182026,0.49451157,-0.6779136,-0.39403668,-0.2129881,-0.32942143,0.4621631,0.20100366,0.42242217,0.43136862,0.54358613,0.031332534,0.95101815,-0.3759323,-0.08795015,0.367959,-0.67794776,0.6232213,0.998995,0.37934676,0.81486785,-0.07346391,-0.57133687,-0.50362384,0.48990428,0.44274262,-0.30568948,-0.6756729,0.99924654,-0.10323138,0.91139627,-0.2034973,-0.31883967,0.99854666,-0.99007636,0.102529615,0.57729214,0.4419514,-0.11136432,-0.14548759,0.24827452,0.21922944,-0.8130962,0.9932097,0.7683928,-0.8329313,-0.27919906,0.50576746,-0.60332197,0.31963477,0.4234261,0.9229876,-0.63944966,-0.11453654,-0.16338348,-0.94451416,0.32739356,-0.28311315,0.48073044,0.6996136,-0.52851176,-0.7279027,-0.30141115,0.5732705,-0.9896706,0.6306793,0.13053913,-0.4411639,-0.40395305,-0.17354618,-0.0079274,0.21979222,0.9187304,0.03377836,0.086225025,-0.46118405,0.7797736,-0.32005253,-0.8396918,-0.04001596,-0.59901166,-0.4490766,0.23536225,-0.49495256,-0.059939783,0.1026644,0.8644121,-0.9938258,-0.55129665,0.3372047,-0.5381451,0.45340684,0.616381,-0.1745204,0.99689454,-0.26600468,-0.081952766,0.11390214,0.06619722,0.54009205,0.25717136,-0.9018572,-0.7235815,0.87384224,0.7155285,-0.070600554,-0.19243483,-0.3782495,0.8293054,0.85067606,0.83078057,0.15743873,1,0.56644094,-0.5727404,-0.27127352,-0.5339221,-0.96933067,0.025715036,-0.5554328,-0.6661664,-0.66381824,-0.56813437,-0.6323939,0.032657597,-0.71127295,0.92563397,0.19740619,0.47239166,-0.5473925,0.26283026,0.3719456,-0.590299,-0.23749578,-0.26470235,0.93068004,-0.49171546,-0.9725097,-0.20220698,-0.50712615,0.48540995,-0.32252437,0.28340304,0.004274338,-0.13331723,-0.1977643,0.35411495,0.66931814,0.75565547,0.4255587,0.13067266,0.66009,0.6488133,0.9998747,-0.21967572,-0.9936528,0.7344614,0.99910945,-0.7577594,-0.6351104,-0.9985185,-0.42832303,0.8018221,0.7243279,-0.53398573,-0.443818,-0.46216372,-0.01955526,-0.75712734,-0.09175369,-0.29246745,-0.49621877,-0.33101276,0.66830486,0.09982688,-0.9999832,-0.9989392,-0.9977404,0.023207493,0.30236462,-0.26716846,0.35796785,-0.861215,-0.9342963,0.473431,0.1019579,0.4443453,-0.8683646,-0.08290598,-0.23477763,-0.030175738,0.16047248,-0.34285966,-0.7790813,-0.97244567,-0.9999122,-0.3083095,0.35655084,-0.001498257,0.65996057,0.71597785,-0.996501,0.009982796,-0.4377068,-0.57134765,0.45369378,-0.2046309,0.10084771,0.9102809,0.5190144,0.05547926,-0.77851695,0.49160686,-0.7540681,-0.44594857,-0.5575327,0.54885346,-0.7945683,-0.65040046,-0.57358485,0.22267197,-0.8311459,-0.18057522,0.06941217,0.13776669,-0.4272913,0.8722193,-0.5779652,0.38491258,-0.002975675,-0.57995313,-0.5338499,0.49693707,-0.31995007,0.30546758,0.4097253,0.99833214,0.8897544,-0.75656855,0.14936839,0.52916104,0.19114177,0.36500862,0.06641681,-0.4434371,0.7696401,0.8970431,0.6075341,-0.37956703],
    [142,1,"CC1(c2ccc(Oc3ccccc3)cc2)OC(=O)N(Nc2ccccc2)C1=O",0.9312369,0.041677307,0.5595332,-0.2852503,-0.06153317,-0.7203711,-0.36556658,-0.25464642,0.10773551,-0.07159365,-0.3738442,-0.249744,-0.31389883,-0.5511076,-0.16917804,0.19844134,-0.69348884,-0.32934874,-0.34154955,-0.132661,0.76241475,-0.1752233,0.63623077,-0.14584836,0.17315556,-0.37281966,-0.019546457,0.41287318,0.38769704,0.22665267,-0.5058844,-0.25359556,-0.4054605,0.4608189,-0.20340748,-0.29342857,0.42363694,0.12249603,0.999473,-0.6624232,-0.7689144,-0.25585693,-0.47157228,0.77950275,0.41168103,0.40326804,-0.5953043,0.058896624,0.80928844,-0.40406877,0.1541181,0.27067852,-0.36982065,-0.39886642,0.44529057,0.6238729,-0.43660486,-0.7222267,-0.019062776,0.27838862,-0.34466085,-0.0009988,0.4722046,0.274817,0.005524972,0.57807904,-0.106166765,0.70494455,0.12319837,0.6451429,-0.59614736,-0.7228233,0.06854843,-0.2828307,0.135291,-0.43880004,-0.112231426,-0.04090097,-0.040696185,-0.9985399,-0.30460772,0.26581037,-0.9071978,-0.2533223,0.17985494,-0.88997567,-0.16679287,0.046676155,-0.14090677,0.094426475,-0.16182438,0.37286454,0.060780175,0.3206174,0.99917924,-0.51049936,0.31052253,0.10911842,0.17970881,-0.48850632,0.4365378,-0.057465203,0.32586008,0.98750484,-0.99887484,-0.7892939,0.349773,0.330839,-0.8992192,0.15816613,-0.08192043,-0.28854623,0.802919,0.112323985,-0.2871193,0.5190856,0.14031705,-0.09557836,0.93775463,-0.14983983,0.4759605,-0.36506823,0.29144832,-0.5005768,-0.41726658,-0.64298284,-0.43700498,-0.78276736,-0.3241634,0.99957913,-0.54220885,0.3469178,-0.1473482,-0.29601634,0.24113305,-0.98763317,-0.19978836,0.6962461,-0.50196594,-0.2406289,-0.99999994,-0.088464074,0.44813526,-0.5129573,-0.3580583,0.52126664,0.033639736,0.57377964,-0.99124587,-0.1252514,0.6943579,-0.004621606,0.1477488,-0.5241861,0.46159813,-0.29647243,0.2340233,-0.8267464,-0.6621524,-0.043687623,-0.24976924,-0.7249004,-0.15942591,0.57885784,0.2567011,0.2946868,0.3730707,0.34934378,-0.111877695,-0.14780574,0.072435856,0.10457436,0.4119822,0.3507405,0.44288704,-0.9108051,-0.39849013,0.000881886,-0.73566157,-0.4779131,0.55491763,-0.9445675,-0.7348489,-0.009636543,0.5214135,0.42658734,0.71681875,0.14059922,0.24253356,-0.4722279,-0.3882707,-0.4429644,0.47480965,0.107313395,0.006119513,-0.56498903,-0.51651436,-0.7925199,-0.30281353,-0.107737064,0.45440456,-0.39480555,-0.014470148,-0.045376614,0.6812317,-0.25115886,-0.18456045,0.028072577,0.73033303,-0.99993426,-0.8190487,0.21330935,-0.3466643,-0.46809307,0.8133174,-0.23608685,-0.73652947,-0.018364167,-0.059828255,0.5736059,-0.057461537,0.31634977,-0.47691604,0.16882743,-0.9416136,-0.19150162,-0.47267035,0.35321465,0.37840986,-0.090298735,-0.41355017,-0.08968323,0.7499261,-0.6770419,0.395749,-0.41440526,-0.5710496,-0.050056342,0.5541163,0.11371521,0.7974202,0.60773766,-0.6212113,-0.55889016,0.29207215,0.5358367,0.06726683,-0.0977257,-0.28740224,0.38997674,-0.29001617,0.15719482,-0.051480196,0.6201968,0.42713425,-0.03587091,-0.24768245,0.41372183,0.6485003,-0.06774912,-0.19022582,0.82555443,0.12419098,-0.8769569,0.5206649,-0.29188618,0.17158282,-0.034290534,0.34693664,-0.34181154,-0.58892107,0.9971051,0.20100802,0.10102039,0.15477844,0.68540525,0.6840073,0.30238962,-0.6776889,0.23976605,0.6138425,0.98497623,0.052661207,-0.10811676,-0.41221878,0.014823132,-0.06974095,0.6354897,-0.8498972,-0.5881446,0.030884048,0.34821796,0.53846,-0.52563137,-0.086684495,0.2855014,1,-0.986852,0.6726728,0.43808877,-0.33006778,-0.5355198,-0.22076918,-0.01988208,-0.6276129,0.27700964,-0.99163663,-0.21994676,0.8724594,-0.11764846,-0.051561493,-0.246959,0.124636665,0.027946489,0.038528394,-0.17359996,0.7391862,-0.16774377,-0.88498527,0.6428745,-0.07330159,0.13441992,-0.03800714,-0.5564433,0.061325863,-0.48045516,-0.8644278,-0.7302592,0.3276787,-0.3419794,0.41663757,-0.35585308,0.5768502,-0.14524482,0.65019137,0.65173805,-0.3693998,-0.076810755,-0.2144063,-0.12940644,-0.34816647,-0.029870586,-0.60434467,0.6072813,0.0238493,-0.37870347,-0.5246728,0.81458485,-0.43357652,-0.9676527,-0.75311613,0.25302732,-0.4419794,0.08879442,-0.5737728,-0.035959024,0.17717463,0.9997639,-0.052710455,-0.10269305,-0.15993595,-0.007394839,0.38108125,-0.36033666,-0.8810163,0.4906386,-0.38089257,-0.008847281,-0.5853898,0.53004885,-0.23696887,-0.5691015,0.33077377,-0.56718916,-0.1623518,-0.9999998,0.03163132,-0.2163941,0.08163807,-0.46606255,0.08446471,-0.7409047,-0.01770014,-0.13273366,-0.3163549,-0.050643627,0.010242674,0.7036358,0.19659281,-0.23262039,0.111370884,-0.093022354,-0.613265,-0.089570016,0.009963074,0.49543744,-0.51384854,-0.27401435,-0.37508458,-0.29492366,0.7753789,-0.014438733,0.2693694,0.5500003,-0.66576713,-0.69170064,-0.49923626,-0.22665064,0.1948061,0.06072799,-0.27642518,-0.03012439,-0.005830898,-0.2595778,-0.00541682,-0.3619836,0.99984086,0.05998675,-0.9786953,0.08010742,0.9997248,-0.5257546,-0.11540343,-0.99829876,-0.13049331,-0.94658256,0.3582147,0.7034554,-0.3497221,0.36896157,-0.749562,-0.25866088,0.1161989,-0.15817007,0.05420023,0.113617264,0.7262308,-0.64005077,-0.9999327,1,0.41631123,0.019656155,-0.20822659,-0.014990392,-0.39437753,-0.016329788,-0.44490716,-0.4256636,-0.12167727,0.19144511,-0.5759824,-0.68214697,-0.039813012,-0.5405841,-0.115888335,-0.18256405,-0.2437688,0.9194307,-0.9994036,0.20533723,-0.38574633,-0.18739057,-0.2793781,-0.7444295,-0.7159236,0.25941083,0.31777728,0.20281851,-0.61901253,-0.16397458,-0.19076888,0.9589013,-0.24557018,0.6334533,-0.23243642,0.21726666,0.22252752,-0.116794534,-0.3046957,-0.5771207,0.010640898,-0.28634045,-0.98697513,0.045728724,0.3930263,-0.07138816,-0.6505623,-0.1264258,0.25685143,0.5250857,-0.41579872,-0.3316498,0.60981375,0.99857104,-0.12627652,-0.16234463,-0.32211143,-0.21906321,-0.12605685,0.9999647,0.80951095,-0.07507696,0.05112534,-0.6833623,-0.059782803,-0.424291,-0.99722815,0.35251608,0.6031311,-0.65318614,0.52824605,0.2611595],
    [143,0,"Oc1ccccc1-c1ccccc1",-0.7192363,-0.024604905,-0.010819795,0.63374823,0.2261093,-0.020232212,-0.6609729,-0.24245249,0.23097008,0.046602994,-0.7493032,-0.13279125,0.28553957,-0.623186,-0.25491607,0.7677458,-0.08919698,0.5280296,-0.039639022,0.16518582,0.26876792,-0.8885958,0.119153194,0.36051664,0.25592342,0.4198227,0.35142782,0.36781478,0.41641185,-0.19891442,-0.17520544,0.1596779,-0.3758079,-0.055891853,-0.35215375,-0.13147026,0.17000334,0.6436099,0.34584945,-0.9668824,-0.9941629,-0.23120776,-0.20263532,-0.3530183,0.5317157,-0.99538255,-0.1520329,-0.019347271,0.959787,-0.25837612,0.26249593,0.1009742,0.24034813,0.111066,-0.9633247,-0.03634361,-0.60804707,0.9525169,0.04661654,0.3564986,-0.07091759,0.10630684,0.5006419,-0.5743446,-0.042838465,0.2725754,-0.123049065,0.6153989,-0.18726897,0.4380032,0.89121383,-0.9357358,0.40725958,-0.22887896,0.6884377,-0.06415758,0.11240408,0.13369215,0.16742265,-0.9933316,-0.67548025,0.2751593,-0.6901536,-0.45303547,0.039664097,-0.49841174,-0.41472813,-0.46311775,-0.4259392,-0.08781856,0.20393379,0.21176209,0.144957,-0.04585493,-0.17519055,-0.01891621,0.5591889,-0.34803876,0.42764416,-0.29320893,0.26450297,-0.27545726,0.096729465,0.47678167,0.85331285,0.49145913,-0.11950714,0.43743423,-0.6219558,0.20426822,-0.52421427,-0.001712189,0.3167442,0.23790552,-0.06994629,0.7040355,0.63090086,0.42481518,0.9987021,-0.19272064,-0.21997154,-0.443683,0.023433505,0.29714882,-0.33091217,0.07128742,-0.10152913,0.09246552,-0.123957634,0.9998097,-0.055246532,0.108212315,0.20101501,-0.30789542,-0.1726991,-0.38067898,0.5108345,0.7622514,-0.66270447,-0.007466824,-0.99988794,0.03065718,0.9949456,0.27040854,0.45178688,0.16378224,0.42094493,-0.054555915,0.9869543,-0.062351167,-0.35614577,-0.48873484,0.19912046,0.45560735,-0.19255494,-0.2743235,-0.29657573,0.99780595,-0.23804547,-0.38697028,-0.9911651,-0.20035653,-0.111798376,0.10022041,0.30240026,0.21773666,-0.186914,0.1489948,-0.42148167,0.35374734,-0.64366794,-0.28189495,0.20181455,-0.103894345,-0.26803523,-0.98187697,-0.750998,0.5260601,-0.54616416,-0.08543827,0.35092205,0.59179187,-0.09608707,0.28741565,-0.93346167,-0.29465994,0.31578052,0.29323027,-0.042923607,0.04296464,0.4745084,0.28700358,0.22280881,0.53336716,-0.015680332,0.18636526,0.3357017,-0.58034164,0.81705624,0.19605444,0.17320012,0.21360184,-0.64484936,0.07256813,0.67040884,-0.036443718,0.64994776,-0.1682857,-0.06836817,-0.97831416,-0.513036,0.42676154,0.50314134,-0.1583897,0.13042505,-0.1424811,-0.3550635,0.056384955,0.29241696,0.38702282,-0.3002965,0.13625309,-0.27004093,-0.47001857,0.9872818,0.09028004,0.15044914,-0.025563903,0.15197362,-0.08851896,-0.2937619,-0.29592,0.5822366,-0.6366304,0.19398221,-0.3993712,-0.48855063,0.014254865,-0.21895508,0.17879282,0.8955557,-0.60572535,-0.43352652,-0.5857277,0.6798412,-0.3882257,0.1089681,0.42178184,0.23875758,-0.13713534,-0.20361757,-0.9576815,-0.50813866,0.50251174,0.39493677,-0.06889072,-0.13814814,0.53687906,0.409135,-0.024309115,-0.2542391,0.38966298,0.28112292,-0.42371216,0.047505744,0.54536164,0.24420747,0.16406126,-0.47241512,0.4309484,-0.23566696,-0.9108778,-0.1761957,-0.008321443,0.51397175,0.9102554,0.18864802,0.04788524,-0.16315714,0.4354039,-0.1507736,0.9995238,-0.080455005,0.68085814,-0.027172534,0.04801661,-0.6747183,-0.065297976,0.7750255,-0.23607281,-0.007411213,0.99924207,0.06410797,0.46532103,-0.41648883,0.4803699,0.9999668,-0.98803574,0.20002559,0.050196696,0.027183617,-0.14591253,-0.2657941,0.36796615,0.22195035,-0.71079314,0.9918267,0.21529543,-0.0670797,-0.29717618,-0.26134098,-0.5788791,0.5077885,0.065317325,0.9480576,-0.5305632,0.35618353,-0.31118625,-0.9822903,0.050831076,0.13896617,0.6672088,0.37680778,-0.6172309,-0.7709187,-0.06824235,0.25021672,-0.9685171,-0.43898398,0.3065915,0.27399313,-0.18883045,0.20654428,-0.4181653,0.24056019,0.6183408,-0.26660347,-0.1760188,-0.37387908,-0.08315739,0.41442478,0.22911285,0.52089834,0.78856015,0.5963582,0.30497417,-0.013006311,0.07541752,-0.5558658,0.90049493,-0.9969508,0.22049859,-0.41809833,0.09111974,0.21205825,-0.17356718,0.16117169,0.99859744,0.08980973,0.05671459,0.053154718,-0.29933384,0.38319248,0.061373618,-0.8816366,-0.032055005,-0.39345518,-0.7849399,-0.38543528,-0.08984926,0.4085059,-0.34826425,0.45855227,0.9579494,-0.3991579,0.9958612,-0.38202038,0.1415415,-0.14533286,-0.24151891,-0.8943575,0.13735405,-0.25042495,-0.74117196,-0.47244996,-0.3955599,0.17845969,0.28318623,0.09570836,0.70996255,-0.10002065,0.15681607,-0.47542983,0.192095,-0.3513332,0.18075609,-0.13983163,0.20292674,0.73409396,-0.018091802,-0.97223544,0.46113116,-0.19566688,-0.0508986,-0.22046031,-0.28311872,-0.19371611,-0.49689767,0.1372945,-0.062456593,0.54399276,0.4493679,-0.09303381,0.044981506,0.26494348,-0.16791497,0.9999508,0.20830174,-0.9859726,0.18248023,0.99927956,-0.5439187,-0.0908128,-0.9979769,-0.23795038,0.6004556,0.5771008,-0.001564095,-0.71766263,0.314885,0.21740882,0.098686956,-0.6010871,-0.45470124,-0.37976992,-0.34785143,0.07377487,-0.40155166,-0.9999441,0.9848074,-0.9885747,0.09068044,-0.051327977,-0.051219564,-0.13148671,-0.6469537,-0.785148,0.5127657,-0.15084207,-0.6797845,-0.824415,-0.5620011,0.21572982,-0.5142406,-0.027824583,0.32405677,-0.11795581,-0.97996885,-0.99991083,-0.5566559,0.007778667,-0.21600142,-0.04419796,-0.016610214,-0.9966536,-0.16293854,-0.6992226,-0.06942422,0.05189375,-0.19087863,-0.27864262,0.93724114,0.54687715,0.8191635,0.50812846,0.56445134,0.23101574,-0.8392918,-0.015530708,0.55721253,-0.21428616,-0.3541742,-0.22788092,-0.21782364,-0.13941385,-0.08193631,-0.20344259,-0.5196493,-0.3078964,0.5694022,0.006357032,-0.23191358,0.22078605,-0.6936834,0.22986415,-0.08999226,-0.08613993,-0.28443852,0.12702847,0.9972934,0.56503373,-0.22805218,0.12236032,0.014069253,0.07762718,-0.17936583,0.25604308,-0.11638148,0.44316238,-0.6077668,0.518686,0.13189292],
    [144,1,"CCC(C)c1ccc(O)cc1",-0.7982687,-0.0626608,0.3440298,0.29152694,0.09240438,-0.24956872,-0.32878295,-0.020754129,-0.14892754,-0.20994824,-0.8467874,-0.5453848,0.054545715,-0.8049846,0.41389865,0.07870296,-0.16942313,-0.31481528,0.3542302,-0.39180657,0.30978382,-0.8671057,0.473086,0.10968217,0.16082932,0.5419124,0.29196253,-0.18560778,0.55323374,-0.28399184,-0.34948328,0.49674863,0.38860658,0.06369346,-0.096048295,0.019872041,0.082753494,0.61367965,-0.3026666,-0.9601398,-0.9970621,-0.14784557,0.3134052,-0.31250104,0.32961336,-0.99589336,0.17244966,0.11999741,0.96468914,0.1459128,0.6535566,0.2363106,-0.49598122,0.19513541,-0.94684136,-0.19236699,-0.41312495,0.9712277,0.24829186,0.1528183,-0.4201849,-0.5075251,0.416034,-0.16762502,0.08156091,0.28036642,-0.22443628,0.4524258,0.16983253,0.20097058,0.8132015,-0.94247335,-0.2604148,0.3306959,0.6187932,0.46667662,-0.46649057,-0.38890368,-0.07544868,-0.9954732,-0.78154707,0.11939476,-0.91295296,-0.0410602,0.31203887,-0.16624035,0.06416349,-0.379655,0.07363242,-0.29429665,0.13928974,0.2955133,0.047647167,-0.35678652,0.11095014,-0.44060457,0.7383681,0.10256514,0.29598764,-0.04099114,0.09354824,-0.048541933,-0.1777771,-0.4439055,0.95531136,0.4798079,0.49957246,0.21533976,-0.92365295,-0.18539797,0.12807877,-0.45575345,0.15335499,-0.13542214,-0.039770238,0.4801726,0.08138887,0.42816603,0.9988915,0.21663658,0.38739997,-0.29479274,-0.52288145,0.11336214,-0.49040398,0.089218415,-0.031362694,-0.33675614,-0.19143492,0.99971616,-0.08864834,0.03829296,-0.48033297,-0.02499788,-0.5779514,-0.44846293,0.34801862,0.7025302,-0.7481862,-0.2375089,-0.9958873,0.29607683,0.9964947,0.386276,-0.34486604,0.02529634,0.027148766,-0.31696475,0.9947828,0.04159054,0.055143483,-0.7365178,0.5104191,0.53657913,-0.13448867,-0.21691002,-0.25372413,0.998948,-0.34384677,-0.5659595,-0.9933606,0.26601917,-0.15238535,0.30056888,0.35938472,0.1870195,0.8197754,0.25310495,-0.50020486,-0.43593672,-0.48995203,-0.32304764,0.4069139,0.020557012,0.010663603,-0.98540395,-0.77924824,-0.17801908,-0.663043,-0.38842052,0.1544103,0.5554006,0.017158361,0.58164436,-0.90433955,-0.13747267,0.56625205,-0.2232878,-0.21812762,-0.13451308,0.4951641,0.32232016,0.1486378,0.20082094,0.079857156,-0.4877689,0.07107962,-0.40542084,0.21430975,0.08258733,-0.46578708,0.25654075,0.25428262,0.11278114,0.42280734,-0.3567261,0.3707592,-0.1923765,-0.23249534,-0.79649377,-0.11602122,0.00383281,0.5116909,-0.5100884,0.3037153,0.2261683,-0.39952654,0.43996483,-0.11955559,-0.23645681,0.01224342,0.14149669,-0.18170764,-0.44436958,0.99893737,0.114556916,-0.15691872,-0.14638442,-0.05091296,-0.25181013,-0.35222003,-0.4473547,0.63153017,0.14725775,0.32419798,-0.39537445,-0.036782425,-0.284375,0.08407188,0.03749273,0.9179921,0.55304044,0.030693913,-0.6842541,0.2639086,0.024069836,0.0459755,0.27084482,-0.67672646,-0.11797971,-0.17003983,-0.9974451,-0.4759517,0.49925745,0.38635364,-0.2995073,-0.6739731,0.1150982,0.59883153,-0.046154633,-0.57429546,0.6577623,-0.5892125,-0.5279441,0.66315776,-0.02160517,0.44336894,0.56288314,-0.7059823,0.28403768,-0.4484322,-0.616544,0.43665007,0.26376262,-0.32227093,-0.38475782,-0.06274938,-0.07643138,-0.41136518,0.46618944,0.24012761,0.9993793,0.4157643,0.55842954,0.006461068,0.3373657,-0.27517122,-0.2114766,0.7822448,-0.021252353,0.21255329,0.9994077,0.17481609,0.78622055,0.03741629,0.06519576,0.99797213,-0.98158544,0.26681235,0.18896897,-0.06781272,-0.34835425,-0.12158103,-0.015707325,0.12681432,-0.7632456,0.9973779,0.37746412,-0.20330845,0.07958613,0.06659427,-0.1981927,-0.019603875,-0.37249294,0.9304143,-0.3697763,-0.35562122,-0.16760284,-0.9650283,0.14467563,0.12950322,0.12412433,0.50259924,-0.6259876,-0.44473124,-0.63995814,0.37084907,-0.96792334,0.4209168,-0.03951725,0.026421523,-0.3895261,0.25246096,-0.21737826,-0.3504948,0.5393122,0.29851958,0.004069843,0.032601345,-0.10289046,-0.27805036,0.073065,0.26483634,0.6796859,0.14357279,0.2817117,-0.4400762,-0.2706537,-0.07617196,0.94961435,-0.9960642,-0.1972886,-0.70215744,0.06972651,0.21162279,-0.002552844,0.46452817,0.9968746,-0.32735074,-0.3858709,0.1433476,0.10836549,0.08816962,0.16919488,-0.77178633,0.10335541,-0.14985625,-0.42597222,-0.3110516,0.65707356,0.4011533,0.20332196,-0.17804071,0.9627468,0.61768144,1,0.11482197,-0.29728508,-0.15992983,-0.27385485,-0.9262795,-0.43073845,0.1796792,-0.50410706,0.10835455,-0.4612264,0.3672203,0.2552797,0.27168837,0.59179825,-0.28829402,0.35333312,-0.27333754,-0.46475098,0.05792523,-0.3308546,-0.53852576,-0.39557913,0.7198361,-0.040797926,-0.97862756,0.23131685,-0.4687574,0.076216035,-0.000846727,-0.3866389,-0.56471,-0.44053063,-0.5142628,-0.13148965,0.53501534,0.10142769,-0.3346561,0.059543617,0.22634016,-0.39899892,0.9999068,0.18665078,-0.9886025,-0.1681593,0.9986475,-0.28968453,-0.3738107,-0.9972172,0.14738397,0.57679045,0.48379725,0.27461982,-0.6332673,0.5028053,0.06876423,-0.2094568,-0.19580702,-0.19290395,-0.09678455,0.23453933,0.25066182,0.009022951,-0.99989176,-0.9990889,-0.99201226,0.2936421,-0.13845131,0.12939364,-0.1306526,-0.5304382,-0.610039,-0.12253594,-0.3164158,-0.39949894,-0.72683287,-0.55546486,-0.120467514,-0.55466443,0.2810533,0.055979338,0.039424274,-0.98826975,-0.99988693,-0.7008213,-0.42294344,-0.09219026,0.34547386,-0.3057306,-0.9959331,-0.00521772,-0.567926,-0.047772456,-0.058970388,0.2739973,-0.2051873,0.930807,0.22117208,0.77221054,0.5600206,0.4620962,0.24562714,-0.8931019,-0.19183303,-0.3748963,-0.5172522,0.05574604,0.08822968,-0.06857638,-0.1407157,-0.5256979,-0.20642896,-0.8042628,0.34563994,0.44338122,-0.37304613,-0.17646983,0.27761656,-0.9153387,0.25755933,-0.22475043,0.086033784,-0.14294437,0.2394127,0.9996471,0.07976923,0.38869783,-0.13046603,0.6315622,-0.017623266,-0.2929844,0.63083154,-0.36667347,0.32254484,-0.19343352,0.76383436,-0.17959005],
    [145,1,"Cc1cc(Cc2ccc(N)c(C)c2)ccc1N",-0.8052115,-0.05169994,0.7969662,-0.57819504,0.41995725,-0.5768417,-0.2531072,-0.5989654,0.04124799,0.23369087,-0.9018358,-0.27665845,-0.5933787,0.105263285,-0.1789608,0.0698964,-0.045290146,-0.5271362,0.31528994,0.08900817,0.40661326,-0.6834111,0.67027205,0.22722879,0.103414096,-0.32111317,0.050950766,0.22635143,-0.18079868,0.35396636,-0.14012995,0.1903407,0.45472968,-0.41286227,-0.28692272,-0.08364376,-0.45136553,0.56058717,0.9596856,-0.7997278,-0.5648449,-0.18943565,-0.85253537,-0.5989463,0.035678037,-0.9782391,0.12169897,0.16508168,0.07757849,-0.35502377,0.19324017,0.15373163,-0.0914247,-0.118407264,-0.91925997,-0.5790349,-0.57329166,0.7684214,0.7122538,0.055908315,0.24336237,-0.19409019,-0.1894673,-0.32192254,0.5766121,0.3107078,-0.09073638,0.52787197,0.117402434,0.09049482,-0.44491845,-0.9157533,0.04640529,-0.60917586,0.49502063,-0.09725739,0.078730285,-0.26987332,0.2543988,-0.9935384,-0.81330085,0.38475442,-0.9434625,0.13816811,0.4136912,-0.8120005,-0.37135866,-0.3827629,-0.008270354,-0.4236238,0.23439746,-0.08759093,-0.16069767,-0.10744325,0.7303474,0.1049638,0.48216486,0.24020776,0.59697664,-0.08066247,-0.2807651,-0.46111175,-0.06995351,0.8161271,-0.37843448,0.2178663,-0.15917142,-0.13024004,-0.99960184,-0.3009757,-0.34722582,-0.061028123,0.08071622,0.23252241,-0.36011812,-0.4011333,-0.24326988,0.24453151,0.99750423,-0.19205798,0.111080885,-0.7453803,-0.3638203,-0.36338544,-0.33240747,-0.00932002,-0.3331063,0.09514059,0.04047395,0.99979603,-0.7541706,0.09615717,0.33624583,0.1167993,-0.11770013,-0.049633086,0.37101677,0.7625457,-0.72952414,-0.06661132,-0.99951833,0.3640208,0.97966725,-0.07423696,-0.031693738,0.12937458,-0.05310482,-0.47653177,0.8263224,-0.01118482,-0.33817887,-0.63995594,-0.22578861,0.19484262,0.3787144,0.65421575,-0.6632931,0.97043616,-0.40366638,-0.06377482,-0.9749442,0.093389034,0.69982827,-0.07669818,0.31673017,0.1713965,0.7399617,-0.6522241,0.18270974,0.15116327,-0.64295137,-0.21417268,0.3346426,-0.5278492,-0.62944907,-0.957687,-0.7412002,-0.13669899,-0.41427013,0.14332432,-0.07311465,-0.53035027,0.36603796,0.33025146,-0.23149966,-0.42703176,-0.2532667,0.10625153,0.44801778,-0.28800157,0.7425666,-0.124787785,-0.08329252,0.009910418,0.21250255,0.12863024,-0.20347503,0.57408154,0.07465724,-0.17392388,0.30602863,-0.772789,-0.5998928,0.105394006,0.6438612,-0.46482655,-0.22010309,-0.66070145,0.21909523,-0.99874914,0.18529187,-0.5263899,0.11724191,-0.24700238,0.32001,-0.22689614,0.4549268,-0.09160617,0.022191666,-0.33473834,0.09272172,-0.722257,-0.5813247,0.64143217,0.99998856,0.08745125,-0.11135897,-0.15723936,0.06557639,-0.65591383,0.44681272,-0.52631253,0.4325132,0.17117062,-0.44616407,-0.25036004,-0.5078199,0.41736922,-0.10393431,0.24666077,0.859751,-0.11389157,0.49773234,-0.3513384,0.70580214,-0.3342463,0.11694056,-0.24691892,0.48109487,-0.25984615,-0.0956093,-0.9795571,0.83871406,0.29740268,-0.14827615,0.6871866,0.7111048,-0.32865727,0.23557156,0.11034321,-0.25425977,0.66760606,-0.32856423,-0.6224352,0.6942894,0.13623787,0.18097696,-0.3799296,-0.9987179,0.20639785,-0.15810771,0.93350184,-0.26589534,0.60424566,-0.5208455,0.12463388,-0.23810388,-0.06610406,0.31634453,0.33152232,0.43638188,0.9994218,0.24885495,0.683295,0.44401917,-0.16984482,-0.34647062,-0.15126488,-0.13180417,-0.24784239,-0.15728296,0.99607617,-0.24825121,0.4025007,-0.033374757,-0.15959278,0.99989265,-0.985458,0.06504882,-0.111143924,-0.2766352,-0.12814732,-0.7414064,-0.41718724,0.4124298,-0.8838917,0.550585,0.10129641,0.5539754,0.12970014,0.07568471,-0.1616999,0.5974116,-0.6335976,0.7506926,-0.7629506,0.41085038,-0.23581122,0.89083713,-0.09293673,0.19076379,0.3697885,-0.31773055,-0.21937284,-0.71245605,0.16410871,0.75266784,-0.77597237,0.14433092,-0.71397287,0.468737,-0.37399173,0.14373015,-0.06526284,-0.6898446,0.48521546,-0.2527304,0.40685397,-0.18698734,0.18468069,-0.09767373,0.12507203,-0.39786112,-0.6195691,-0.38992527,-0.0651196,-0.42937368,-0.06474065,-0.16054054,0.5206356,-0.9932781,-0.2593508,-0.23912819,-0.35130987,-0.4071628,0.64338374,0.14260215,0.99951434,0.48354152,0.0436836,-0.22671631,0.49173683,0.39847487,-0.5800815,-0.87504697,0.5027669,-0.23280582,-0.08306706,-0.2481229,0.16842277,0.16901235,0.41058317,0.13053283,0.7247075,-0.029372804,0.9990654,-0.3451817,-0.29706386,-0.077747814,0.636766,-0.45342153,-0.7532336,0.007973481,-0.55009276,-0.42846692,-0.3312348,-0.10092547,-0.013133954,-0.23074341,0.68690413,-0.075315565,0.2391158,0.23015408,0.21611537,-0.049868803,0.07043456,0.3417535,-0.12954988,0.3859456,0.14253372,-0.78224707,-0.3373369,-0.10434061,-0.21163094,-0.000451373,-0.5486212,-0.40629104,-0.8896662,-0.40919906,0.5583516,0.6887505,0.3119039,-0.23417273,-0.5585804,-0.3998855,0.35744822,0.9509822,0.58575225,-0.98319536,0.17069708,0.999537,0.38897806,-0.51944655,-0.9848906,0.10641867,0.42082822,0.19321668,-0.3450168,0.2774175,0.049851887,-0.78013223,-0.2877547,-0.12663296,0.20512643,-0.06896889,-0.34027612,0.6727162,-0.31969252,-0.9999674,0.98754776,-0.934097,-0.31246722,-0.1262434,0.52488464,-0.3542002,-0.7893801,-0.22636503,0.6786872,0.38250932,-0.40911403,-0.9252925,-0.07236168,0.37216046,-0.4886976,0.5961898,0.0177587,-0.078400984,-0.72500473,-0.99992716,-0.13891846,-0.21543492,-0.077263474,-0.07844544,-0.23579144,-0.9673231,0.12069067,0.37705562,-0.5013574,-0.3715522,0.069216534,-0.3700583,0.9721746,-0.77409714,0.38672155,-0.5186263,0.5479292,0.65645087,-0.7133075,0.34895104,0.34304813,0.39666858,0.15010123,0.21015939,0.60911685,-0.010602157,0.3861829,0.20111817,0.008504388,0.32601228,0.5347522,0.22702539,0.46825477,0.16865751,0.76925546,0.3860568,-0.26398847,0.33897626,-0.7949133,0.4563258,0.9999147,0.6401081,0.22156818,-0.39889416,0.26454568,0.4437596,-0.15515715,-0.9238766,-0.053944502,-0.26365066,0.40148127,0.55781054,-0.32912168],
    [146,0,"N#Cc1[nH]n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(=N)c1[S+]([O-])C(F)(F)F",-0.1503618,-0.15328409,-0.5286597,-0.09887469,-0.21236126,0.20585635,0.44241202,0.62763005,-0.3062532,-0.15356563,-0.018638164,-0.18828358,-0.43999866,0.6920082,0.6821222,-0.9261307,-0.6669665,0.7386861,-0.43165487,-0.3392472,0.311318,0.57868326,0.63262224,0.5862014,0.2153392,0.3495279,0.6035229,-0.048576564,0.906881,-0.31835207,-0.45776093,0.16513301,-0.40284404,0.055642337,-0.3274473,-0.43387857,0.5373158,-0.56237316,0.999661,-0.288251,0.08022296,-0.23567031,0.22577816,0.6294338,-0.3881644,0.40779138,0.47448373,0.2031469,0.7979325,0.21654916,-0.4850258,-0.56748986,0.3911687,-0.14566696,-0.29676124,0.6180558,-0.8229517,-0.9548807,-0.73268974,0.23605596,0.79120994,0.15834738,-0.16572788,0.033962484,0.34373873,0.07260388,-0.31080535,-0.4767585,0.5186218,0.040504247,-0.8262235,-0.74658203,-0.3883249,-0.82333237,0.6487791,-0.5232968,0.81371635,0.18848246,-0.80525655,-0.9988502,-0.34662268,-0.5375495,-0.9737885,-0.38672405,-0.62124914,-0.66472304,-0.3630046,0.7507458,-0.59097505,0.62409824,-0.70876455,0.5114189,-0.057027433,0.68121266,0.99936426,-0.20070814,0.071767025,0.72327566,-0.19791737,-0.49954107,0.75862277,-0.7847819,0.22863762,0.10701798,-0.99934936,-0.71365136,-0.33106294,0.5468193,-0.99911284,-0.5934747,-0.66663814,-0.25631115,-0.27208644,0.7827166,0.46155107,-0.39333788,0.8768517,-0.42684996,0.9826298,-0.8294623,0.61002684,0.3693161,-0.21516852,-0.17617083,-0.6174471,0.7240119,0.1269631,-0.54703975,-0.335004,0.9991763,-0.56996137,-0.17484193,0.8643084,-0.2778048,0.43574885,-0.8440717,0.6220862,0.4609376,-0.5543741,-0.5022244,-0.99993366,0.6173939,0.2945663,-0.7364536,0.24367578,-0.38925198,0.45534232,-0.8500407,-0.9950471,0.000951763,-0.611093,-0.20554544,-0.017723959,-0.39905855,-0.20671241,-0.6206168,0.06459564,-0.83672595,-0.8127769,-0.16774277,-0.1421891,-0.11905768,-0.26644337,0.19677678,0.54167813,0.36827815,-0.09777943,-0.2871112,0.07155249,0.47588205,-0.5653396,-0.18029091,-0.5713789,0.42722145,0.49840763,0.7479679,-0.6691986,0.24772756,0.6105166,-0.43162823,-0.5595828,-0.9622066,-0.83981436,-0.69189996,0.8244039,-0.19629289,0.77801204,0.37109944,-0.8425102,-0.82967234,0.40716174,0.6957425,0.22685754,0.057406653,-0.70327103,0.4806231,0.09058963,0.84844726,-0.19416553,-0.41408122,-0.36858457,0.21874088,-0.859226,0.028727155,-0.35992098,-0.43006685,0.12517273,0.27020586,-0.31379512,-0.9998227,-0.15946703,0.3360371,0.05848174,0.15461151,0.09093596,0.7792768,-0.09107199,-0.5141045,-0.50719684,0.3947165,0.35004097,-0.458985,-0.08731686,0.1269603,0.9582563,-0.23984003,0.3823968,0.10878586,-0.7012642,-0.68715394,-0.56125414,-0.51421106,0.38377547,0.5223163,0.62951887,-0.0688653,-0.43206993,0.6687006,0.22538762,-0.54834175,-0.9976984,0.42194012,0.78161025,-0.2840959,-0.6410083,-0.231256,0.08491076,0.5540835,-0.68990403,-0.30955637,0.5795398,-0.97363794,-0.11851016,-0.18040574,0.17314036,-0.54334694,0.431484,0.6018213,-0.6459582,-0.15078624,-0.24426939,0.4257655,0.004355846,3.65e-05,0.58660126,-0.14787409,-0.37088054,-0.03911015,0.381088,-0.7809258,-0.65018827,0.9999792,0.44103175,0.3468355,0.002733341,0.8405674,-0.5771158,-0.5363935,-0.69190603,-0.8374306,-0.26029128,0.97942686,-0.06780046,-0.049977366,0.7532347,0.17674802,-0.8791851,0.4959303,-0.75520283,0.37476182,-0.4607102,0.3967295,0.47074413,0.7591082,0.34473476,-0.24642971,0.99994326,-0.9774589,-0.12447242,0.38906342,0.5786349,0.008558041,-0.5742671,0.120484985,0.56969094,0.34075135,-0.98235,0.588272,-0.31395328,0.36532146,0.75227183,-0.31873906,-0.24827683,-0.6028388,-0.17666712,0.35240185,-0.36791217,0.25859606,0.5145765,-0.5099353,0.65102565,-0.8300989,0.94469714,-0.0325253,-0.28761327,0.46257138,0.053032875,-0.85891414,-0.31143844,-0.11379174,-0.7745159,-0.37326306,0.048743684,0.8242083,0.44427377,0.39420053,-0.33059183,-0.32578033,-0.07823976,0.67299104,-0.6590915,-0.1534596,-0.12151779,-0.9189777,-0.13671309,0.7004512,0.15042898,0.63057125,0.03746738,-0.92056936,-0.35164762,-0.50936735,0.042540826,-0.5056454,0.16318564,-0.0355821,0.28066218,0.99973434,-0.20493479,0.5265778,-0.59208506,0.28397766,-0.03343897,-0.31250978,-0.76553595,-0.4664349,0.3116614,0.79594177,-0.04699985,-0.013414524,-0.5504598,0.3144096,0.72701365,-0.8662668,0.41517055,0.98091424,0.24299726,-0.2243117,-0.0148997,0.23620453,-0.6762824,0.43387198,-0.6835657,0.092508696,-0.40538916,-0.69078374,0.14054409,0.037123796,-0.35800058,0.7086714,-0.53956187,-0.61599886,0.055880632,0.3430564,-0.29208013,-0.7539815,0.142569,0.025862614,0.7983699,-0.20772417,0.91241026,-0.38145098,0.2050563,0.24877109,-0.39607626,-0.08101531,-0.54414874,0.916077,0.18094473,-0.74489194,0.7208577,0.09619048,0.13796628,0.773492,0.7432591,0.8603061,0.9754728,0.11841526,-0.98442465,-0.008464713,0.99726975,-0.89075166,-0.08273625,-0.99047625,-0.7126342,0.22966297,0.6895883,-0.08497939,-0.07057105,0.5553419,0.07180102,-0.7062662,0.78716415,0.046737537,0.31481487,-0.30125225,-0.042858236,-0.1387831,-0.9999886,0.9953402,-0.3674192,0.12379442,-0.7940158,-0.660801,-0.5834233,-0.5494718,-0.77234584,0.26930386,0.027518623,0.85336655,-0.6352198,0.6637122,-0.33789486,0.14711407,-0.36714947,-0.4510382,0.22033447,0.9290392,-0.99967223,0.15834689,-0.08778483,-0.43019927,-0.7933464,0.60453796,0.051822826,-0.15596299,-0.37104097,-0.095089436,-0.10629863,0.25346416,0.42711237,0.939135,-0.61132,0.63890356,-0.1858231,-0.07802591,-0.32056168,0.39066255,0.12107206,-0.47627127,-0.30315453,0.015175556,-0.99984115,0.8245032,-0.1705394,0.020262014,-0.49039796,0.24686797,-0.06975137,0.91590667,-0.4730871,0.67959875,-0.20236054,0.9961252,-0.020213807,0.47154027,0.25085634,0.41437125,0.117336206,0.99873585,0.36502424,-0.43544126,0.036012534,0.7762819,0.3850871,0.22695856,-0.99762404,-0.49922922,0.7536671,0.46530816,0.4998546,-0.36927336],
    [147,0,"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F",-0.8378938,0.46784186,-0.9603299,-0.2272493,0.5789127,-0.83601654,-0.24399824,0.026961144,0.2162433,-0.65507346,0.2126351,0.5076081,-0.46049598,0.9065585,0.22358932,-0.99865794,-0.6882753,0.66700506,-0.08553811,-0.76584417,-0.8363208,0.506404,0.80266184,-0.7062354,0.80580795,0.7159628,0.5126348,0.24086322,0.9820256,-0.034416426,-0.71458566,0.78949165,0.41877615,0.2124616,0.24559411,0.9096077,-0.071811676,0.57124096,0.99988127,0.7448179,0.3029692,-0.3461414,0.324277,-0.6728136,-0.26942208,0.96586794,0.7931362,0.5024259,0.9860207,-0.5632538,-0.27395093,0.32832292,-0.15502302,-0.61344695,-0.5363773,-0.548106,-0.8550636,-0.9986405,-0.9059033,-0.27539766,0.20995991,0.03968977,0.5067371,-0.38606286,0.08356723,0.56401974,0.01920529,-0.6739391,-0.27152133,0.5038168,-0.86289144,0.8228968,-0.36460796,0.83947635,0.7862076,-0.82918805,0.81301457,-0.6510219,-0.77160674,-0.9941536,0.31418234,0.64989364,-0.7968966,-0.19417666,0.64589286,-0.9329905,0.29129472,0.28346187,0.4487062,0.68071014,0.6078347,0.7656439,0.57502383,0.3664941,0.9830439,-0.49356917,0.6694798,-0.031208487,-0.45494908,0.69342035,-0.39406174,-0.32985508,-0.036689397,-0.45412377,-0.9999517,0.7575246,-0.12279933,0.28861323,-0.74824584,-0.47675297,-0.5370011,-0.31600916,-0.8868989,-0.7799733,0.6392811,0.894528,0.25800362,0.8952117,0.3362849,-0.8148923,0.8322739,0.016583258,-0.22599614,-0.11985739,0.35710883,0.43397275,-0.60149306,-0.10612849,0.2320121,0.9998974,-0.4264034,-0.5403636,0.9241682,-0.67567664,-0.3136769,-0.87908745,0.460217,0.6233318,-0.90516925,-0.77368337,0.9993295,-0.36905834,0.69255894,-0.24032469,0.41883135,0.33183187,0.83322996,0.007582454,-0.999836,-0.13880822,-0.47051784,-0.4350678,0.10337875,-0.7134797,-0.8306229,-0.5426498,0.24046361,-0.9984897,-0.9873955,-0.28181648,0.93612546,-0.4750152,-0.6991784,-0.08784417,0.68330896,0.19005671,-0.7777671,0.59656066,-0.38840932,-0.24567589,-0.9130442,-0.9329001,-0.47153458,0.9045562,-0.54799694,-0.93195415,-0.9109329,0.70948327,0.39554834,0.72557604,-0.8362918,-0.1608769,-0.6357713,-0.96824133,0.984864,-0.8400254,0.35151592,0.76010674,-0.67813855,-0.97223115,-0.21491046,0.81998736,0.75534654,-0.021724047,0.005931255,0.22951955,0.45798707,-0.7048103,-0.13084422,-0.67124695,-0.8459218,0.5510055,-0.45528346,-0.7956828,0.648323,-0.19556113,0.568489,0.71242577,-0.7631533,-0.99985284,-0.52234215,0.8502365,0.77307415,0.36583093,-0.93277013,0.46146092,-0.2761574,-0.2833156,-0.26608086,0.4199253,-0.15785015,-0.14153671,-0.33104274,-0.09769987,0.9530491,-0.24625094,0.62198937,-0.11018762,-0.042471703,-0.8854236,-0.62096345,-0.21063098,-0.035841525,0.22440293,-0.71151227,0.6483836,-0.43742606,0.4850573,0.051141754,-0.19143093,0.48080757,0.93872756,0.85168356,0.03623526,-0.99060273,0.12726095,-0.31451893,-0.10438585,-0.8684886,-0.09500417,0.77830815,-0.99956465,-0.8702684,0.040908854,0.20771982,-0.77264756,-0.498448,-0.42176038,-0.48638415,0.42342567,-0.4671818,0.4576958,0.065823466,-0.6590716,0.606791,-0.8248985,0.5466333,-0.033589303,0.9608901,0.6189859,-0.8946898,0.9961595,0.7849003,0.6073414,-0.45603895,0.8998866,0.0924748,-0.9292358,0.22354768,-0.9970247,-0.57118803,0.20153491,0.08066291,0.16371104,0.27709538,0.59733146,-0.9028335,0.9180857,-0.83778596,-0.95251054,-0.76546913,-0.9411101,-0.81613785,0.5358898,0.4946765,-0.54650277,-0.9937941,-0.9985797,0.026772281,-0.24307975,0.36134583,-0.7317668,-0.57863206,0.6943091,-0.5973344,-0.19069274,-0.9996742,0.4038304,0.16830286,-0.009561946,0.55966955,-0.4419676,0.084325284,0.69634086,0.72726655,0.8514295,-0.6187515,0.27116156,-0.92094773,-0.31002828,0.23123795,0.79529935,0.8861081,0.44763812,-0.50565326,0.8743152,-0.037237093,-0.9757647,-0.9317253,-0.5500054,-0.81868833,0.23608688,-0.40145332,-0.17945576,-0.04373468,0.9918262,-0.9037107,-0.6957983,-0.14565578,0.33605018,-0.8118289,0.5303678,0.8912067,-0.96199155,-0.069735646,-0.759115,-0.05372671,0.4752764,0.70504016,-0.9899478,0.86845577,-0.3344111,0.76205266,-0.30532974,0.2963983,-0.32979485,-0.4587647,0.9998715,-0.41888562,-0.7632428,0.34666052,0.6593804,0.013927141,-0.5301559,-0.9743391,-0.07290136,0.77584547,0.9261944,0.42518833,-0.25030637,-0.2981555,0.21544145,0.9177342,-0.4839204,0.34202912,1,0.5904036,-0.7608052,-0.07796041,-0.52332693,-0.78483397,-0.18561472,-0.83890545,0.41662833,-0.27980036,-0.46983024,-0.5764047,0.8282746,0.72183764,0.650585,-0.16077687,-0.4142209,0.5089559,0.41873702,0.4522835,-0.9995056,-0.83603704,-0.77341056,0.7565458,-0.63526356,0.7105942,-0.39409906,-0.003901933,-0.3020413,-0.1352139,-0.53088367,0.053666648,0.26927194,-0.54671806,-0.22722895,0.7687462,0.11303352,-0.11541524,0.6875173,0.74953365,0.84392464,0.99976385,0.41242206,-0.99444276,0.21178322,0.9968745,-0.9852609,-0.37788847,-0.9991685,-0.35400623,0.012674192,0.036992792,0.25595027,-0.28241375,-0.4502076,0.48634806,-0.9837861,0.13165404,-0.3988882,-0.71406424,-0.3461825,-0.39819795,0.14009783,-0.9995076,-0.9999994,0.673922,0.32425225,0.40613392,-0.41723,0.5591044,-0.80664814,-0.19091386,-0.31021237,-0.8388589,0.8619932,-0.7019431,0.26306364,0.22525287,0.34700868,0.32023045,0.54752135,-0.7615961,0.9932407,-0.98769355,0.7423355,0.6787706,0.4468088,-0.08670447,0.14710063,-0.90111935,0.22767949,-0.41313228,0.20844091,0.5288546,-0.07061068,0.43480897,-0.94385463,-0.33137324,-0.5457737,-0.35484776,-0.7737962,-0.63854617,0.50186884,-0.59825706,0.097063124,-0.8612077,-0.8745246,-0.999791,0.23051278,-0.43185988,0.03447525,-0.16317916,0.39952052,-0.23940463,0.9243363,-0.82223874,0.24843736,0.43615553,0.99963975,-0.3868728,0.86139804,-0.111773156,0.38935837,0.42747587,0.9793993,0.9244037,-0.81494045,-0.12373794,-0.40484262,-0.7812639,0.90805703,-0.9990987,-0.06281091,0.6061371,0.98966473,0.9048922,0.07376812],
    [148,1,"CCCCCCCCOC(=O)c1cc(O)c(O)c(O)c1",0.7873072,0.6217821,-0.111941926,0.4152453,0.34368044,0.27033252,-0.281172,0.048969634,0.14690034,-0.06347976,-0.49070424,-0.29786852,-0.15494657,-0.8210015,0.5604991,0.7363975,0.8297315,-0.50496113,0.31782266,-0.089254156,0.07771974,-0.571667,0.6971488,0.65610754,-0.21347697,0.40114072,-0.12546843,-0.7241243,0.4558182,-0.27251747,0.031457525,0.5220218,0.11115846,-0.24163778,0.38956824,-0.5263397,0.3379163,0.5108245,0.9894765,-0.5318789,-0.87447953,-0.08836606,0.14831626,-0.06570735,-0.4637883,-0.8326962,-0.16173072,-0.49088272,0.71789527,0.39608493,0.8428848,0.45142946,0.1342654,-0.34806338,-0.24749133,0.1865428,0.68728673,0.51450217,0.6627599,-0.04904136,0.24951418,-0.61857367,-0.010849735,-0.118529424,0.07219066,0.60941386,-0.006556517,-0.11968727,0.6812659,-0.36033067,-0.7652266,-0.9448553,-0.2482076,-0.11425688,0.7161898,0.44714677,-0.38565525,0.6843951,-0.3838318,-0.9985358,-0.97416884,-0.1402542,-0.8704062,-0.041601032,0.25421464,-0.7594825,-0.053364582,-0.104395576,-0.25492015,-0.713639,-0.39186922,-0.016507486,0.30884525,0.06801525,0.9977575,-0.30271578,-0.17415647,0.20604612,-0.3356225,-0.3391149,0.1502765,0.30624303,0.6112467,0.93316865,-0.8712121,-0.6381641,0.59012175,0.019758388,-0.99999285,0.68280727,-0.055202525,-0.3824863,-0.07361626,-0.21836165,0.15617816,0.24889442,-0.092351966,0.18465656,0.99533683,0.30764404,-0.22936638,0.24720171,-0.27342808,-0.019628212,-0.88243806,0.23767823,-0.22567068,0.6988473,0.26147175,0.99928975,0.6424891,-0.12964666,-0.69073814,0.08543074,-0.76966447,0.4798479,0.18361059,0.54584116,-0.34487173,-0.3445454,-0.9984522,0.32953852,0.7094153,0.38379753,-0.5816482,-0.3360636,0.793624,-0.71358883,-0.011897866,0.15297942,-0.2189019,-0.77856916,0.6050594,0.26460454,-0.5184748,0.32127592,0.7542549,0.87049043,-0.80485785,-0.080597386,-0.92357594,-0.14084095,0.5932387,0.33704543,0.5625822,-0.118384026,-0.320102,-0.7040886,-0.19530673,-0.48020065,0.21916644,0.12437224,0.439051,-0.33659372,0.41380093,-0.86097133,-0.6382607,0.4891473,-0.6466194,0.33376414,0.42916632,-0.9746182,0.009780445,0.7155536,0.117885105,0.41999435,0.17098366,0.3653429,-0.678845,0.3216487,0.26184127,0.41680884,0.56105554,0.25488508,-0.17846283,-0.13190614,0.115683414,0.78307146,-0.42949677,0.20389588,-0.6768615,-0.53512925,0.16590099,-0.21569432,0.093323,-0.87101036,0.57246405,-0.08745792,0.17368929,-0.99951184,-0.21908501,0.4730344,-0.29182804,-0.48123488,0.43104514,-0.5405272,0.4900609,0.60676074,-0.20187095,0.134929,-0.48154843,-0.57249767,0.07723331,-0.09081949,0.9999999,0.36748713,0.35871083,0.18655512,-0.3829519,-0.4164769,-0.44446504,0.49912637,0.5597415,-0.26649526,-0.47544053,0.12845106,-0.48022094,0.16792208,0.7284276,0.8011253,0.84228253,0.3897948,0.023335362,-0.35277855,-0.24961491,-0.105114214,0.47916028,0.4506567,-0.046351843,-0.3032643,-0.35760957,-0.9983262,0.21259616,0.7492662,-0.40432388,-0.60751575,0.17163268,-0.55192226,0.7564421,0.4245439,-0.5347202,0.46950245,-0.07599773,-0.83842236,0.40273115,0.13760531,0.84448695,-0.7368497,-0.9890012,-0.44854298,0.18125373,0.9251011,0.074425735,-0.2657934,-0.755559,-0.44751993,0.17323188,0.5806333,0.46177655,0.30497938,-0.055577725,0.9986481,-0.7272494,0.4840438,-0.6250415,-0.5591181,-0.22137485,-0.87673527,-0.9562621,0.22771114,-0.36543524,0.99090534,-0.758419,0.22199371,-0.47786912,0.63185346,0.99821645,-0.9241388,-0.6177793,0.3119177,-0.184603,0.08936147,-0.51041204,0.26438352,-0.52654386,-0.8937443,-0.45337898,0.31206906,0.36468327,0.5261233,0.57146955,0.44560546,0.2554391,-0.13181517,-0.306531,0.21643876,-0.31546205,-0.37205967,0.9998977,-0.09900552,0.17793113,0.5151241,-0.21932313,-0.93003607,-0.37068278,-0.57022357,-0.12445487,-0.65734494,0.43849772,0.51694095,-0.0788768,-0.3374284,-0.050869286,0.118263185,0.11076372,-0.17326094,0.407606,0.04213676,0.90499115,-0.3491547,-0.42703196,0.6043631,-0.080783956,0.21585232,-0.1112868,-0.551054,-0.7334713,-0.6366604,0.15589365,-0.20815991,-0.9662432,-0.2577594,-0.42737353,-0.6094149,-0.20325117,-0.2470462,0.73887396,0.9997438,0.09094247,0.81239736,-0.10117255,0.62312347,0.3509066,-0.3224874,-0.50749296,0.279942,-0.3765971,-0.13796958,0.44397193,-0.62294847,0.12628733,0.19039251,-0.66569227,0.35717633,0.04794924,1,0.084729895,0.19028996,-0.7760916,-0.30289456,-0.12471281,-0.30326542,0.18773788,-0.35175633,0.36444706,-0.50541794,0.4603975,0.4871069,-0.36616594,0.6390123,0.061587438,-0.2806188,-0.23637274,0.1563326,0.14461792,-0.94715863,0.6021078,-0.019739559,-0.84155935,0.47038943,0.760826,-0.07373019,-0.7974584,0.087223694,0.20896553,0.36783743,0.29051837,-0.48296928,0.070186526,-0.23976967,-0.6907355,-0.19323026,-0.51428044,-0.52816355,0.6695795,-0.3384579,-0.9094571,0.10108276,-0.9503993,0.20027162,0.99937105,-0.7786241,-0.7608463,-0.83605903,-0.5575643,-0.6447453,-0.14792494,0.21256554,0.2167654,0.6101492,0.34035972,-0.78196293,0.19896778,0.482629,-0.59544474,0.18124077,0.22257061,0.16622745,-0.9999528,-0.9981935,-0.7563057,0.47678167,0.46831942,0.6754994,0.4205051,-0.8752416,0.7816442,-0.5894826,-0.11810832,0.67306966,-0.7389104,-0.12691493,-0.22091731,0.18910897,0.6846537,-0.7067069,-0.19533525,-0.38386112,-0.9998407,-0.8120152,-0.17747992,0.1505462,0.5286571,0.47672367,-0.36853415,0.7809907,-0.7148899,-0.6849889,-0.124321274,-0.5141192,0.26295164,0.9173737,-0.15731077,-0.8896827,0.36241025,0.688092,-0.7266221,-0.9023553,-0.010652728,-0.35582432,-0.7689069,0.6084566,-0.8612501,0.3755589,-0.20529585,-0.23938634,0.4039575,-0.25380278,0.24877861,-0.108962454,-0.8781547,0.22393632,-0.15736198,0.97088856,-0.06422031,-0.30839851,0.011777872,-0.085032515,0.55048734,0.99999833,0.57495755,0.2538327,0.100566894,0.6644589,-0.14813635,-0.54228276,-0.98740596,-0.18610592,0.49819478,-0.7036263,-0.39373526,-0.79590726],
    [149,1,"C=CCc1cc(S(=O)(=O)c2ccc(O)c(CC=C)c2)ccc1O",0.08785365,0.1834862,0.42411274,-0.087187305,0.6706,0.7016408,-0.31472683,-0.7878498,-0.13081843,0.13788883,-0.26819265,0.23756692,-0.7113631,0.28923082,0.44444096,0.17094341,0.19877028,0.31033278,-0.008442244,-0.027425433,-0.05505441,0.08117285,0.6692159,0.4871625,-0.63822955,0.5169633,8.21e-05,-0.3500124,-0.22363149,-0.13407424,-0.5571118,-0.5052274,-0.26881,-0.03518896,-0.22858486,0.37758988,-0.30696145,0.7623029,0.9995068,-0.044062216,0.020117607,0.2307273,-0.17685463,-0.7520486,0.42934433,-0.4813014,0.27989563,0.08718061,0.9023455,0.55624616,0.41473398,0.13838796,-0.68425924,-0.32198876,-0.5489039,-0.12433991,-0.21520397,-0.6483396,0.64920944,0.1453949,-0.18382418,-0.40283558,0.4092829,-0.057871345,-0.26307678,0.39914396,-0.679239,-0.14088139,-0.072342515,0.119013965,-0.2631625,-0.8894968,0.41574746,-0.29761988,0.3715137,0.31848755,0.6993889,-0.67686814,-0.052985456,-0.998905,-0.919345,0.007132319,-0.9333212,0.07515638,-0.41457847,-0.80637586,-0.17336833,0.1374271,0.38001022,-0.42181483,0.32450595,-0.5909394,0.038646884,-0.7920962,0.9981942,0.081828564,0.6243973,0.04179851,0.28978252,0.60748786,-0.13400692,0.49974537,0.67345494,0.6317465,-0.99674153,-0.23067848,0.1523589,-0.311218,-0.9995496,0.048997093,-0.27470198,-0.44860816,-0.26969543,0.032382727,-0.22735216,0.10116795,0.04971859,-0.51852536,0.98834133,-0.25905094,-0.011485492,-0.85253716,-0.18096724,-0.27773896,-0.6240599,0.52442056,-0.0332324,-0.11217674,-0.3701367,0.9997502,-0.6959975,-0.055335574,0.4725516,-0.34765017,0.48160604,-0.53269446,0.40675715,0.75174475,-0.684353,-0.4864797,-0.99976915,0.41473302,0.7106659,0.77371866,0.73303324,-0.4204719,0.09182165,-0.3715445,-0.9551403,-0.49708968,-0.62144667,-0.9131037,0.27606073,-0.31263793,0.10108224,0.32841694,-0.4621529,-0.45350385,-0.7601786,-0.6791765,-0.8118392,0.27219978,0.08981418,-0.14561479,0.51588774,0.6394008,0.6191831,-0.48848316,0.38527533,0.14812076,-0.69120777,0.54386526,0.67136496,-0.018688194,-0.15628867,-0.9300737,-0.72569275,-0.22113971,-0.43213335,-0.25270656,-0.19150332,-0.977191,-0.13217528,0.17046419,0.6876145,0.041190207,-0.15658766,0.14407529,0.4265596,-0.025159096,0.715059,0.20351583,0.4167086,-0.31425175,0.3853257,-0.7713862,0.2123127,-0.11355155,0.53956175,0.4722131,0.29670554,-0.6242472,0.6901535,0.31920046,0.27762026,-0.6028057,0.7749774,-0.19899568,0.25506258,-0.999928,-0.1326813,-0.7332445,0.49538016,0.26960677,0.021687577,-0.00178458,0.68671966,0.165664,-0.39633027,0.29151052,0.17906716,-0.4805517,-0.3503024,0.53535,0.99996555,-0.45881996,-0.5977902,0.60199326,-0.14955013,-0.19384453,0.21242772,-0.4291448,0.4049592,-0.3239515,0.08448569,-0.13563937,-0.34027427,-0.45733887,0.63246936,-0.08390172,0.78496164,0.8761107,0.279149,-0.6536238,0.37330243,0.21937875,0.5294168,0.27795935,-0.20584725,-0.40703937,0.006203679,-0.96195143,-0.53815013,0.5307689,0.29640487,-0.32511175,0.3886142,0.19710621,0.038722172,0.23086944,-0.27933785,0.46714497,-0.17753431,-0.693659,0.47263557,0.024615956,-0.09580436,0.058961675,-0.4153002,0.01700799,-0.357763,0.9978164,0.034962952,-0.07510806,-0.47351414,-0.8000696,0.16701736,0.2815498,-0.050999384,0.7266497,0.5146136,0.9951132,-0.122476384,-0.21255541,0.12411023,-0.57929647,0.23003608,0.07915768,-0.69189346,-0.42601368,0.44622216,0.8582518,-0.3126311,0.86689985,0.55643654,-0.22265758,0.9998104,-0.9845891,-0.7251189,-0.39068747,-0.0315367,0.14679141,-0.8398085,0.60011333,-0.26625627,-0.94679606,-0.9636189,-0.46676975,0.5611738,-0.5482667,0.5782805,0.21329014,0.70042366,-0.13486537,-0.611919,-0.37454197,0.35197186,-0.29627442,0.92061925,0.7158997,0.538375,0.57347643,-0.27385482,-0.6743205,-0.35445273,0.36384463,0.21340556,-0.8233751,0.6213459,-0.5932234,0.5083367,-0.29443437,-0.16408429,0.23393434,-0.41581598,0.3960901,0.46072844,-0.29887867,0.61886084,0.09583834,0.17000037,0.28698754,-0.11108252,-0.11373968,-0.08315778,-0.035202038,0.284604,-0.25004074,-0.2910546,-0.67926985,-0.87221664,-0.24646874,-0.5796016,-0.5378094,0.5885296,0.36096644,0.17591316,0.99988514,0.47926477,0.8434451,0.46084976,0.06804909,0.22946055,-0.30710354,-0.8222642,-0.15389547,-0.62211466,0.40056252,0.56030756,-0.08041079,0.3558749,0.06846587,0.37072247,0.23307784,-0.4282821,0.9926587,-0.012014882,0.19077165,-0.34923124,0.8998282,-0.6427339,-0.34251875,-0.79585165,-0.5129104,0.08637184,-0.036750227,0.17232911,-0.20402707,0.67622304,0.6143739,0.64570695,0.40708467,-0.65391475,-0.8305603,0.6161877,-0.8001366,-0.04930232,-0.60206187,0.5361538,0.21482578,0.5937555,0.14649674,0.22736958,-0.51723075,-0.2029906,0.041801456,-0.020247376,-0.50186306,-0.20041536,0.15659814,0.3119637,0.53013974,-0.065867834,-0.47235322,0.1420974,-0.41429955,0.951525,0.74741375,-0.9849284,-0.27927652,0.99944216,-0.12929831,0.0775334,-0.9884848,0.030523831,-0.027672237,0.69570625,-0.6204964,0.4328435,0.5829352,0.16629289,-0.5698375,-0.36555848,0.47998285,0.33296975,-0.6096118,-0.010874365,-0.22015223,-0.999971,0.9959605,-0.5328273,0.20199023,-0.78593665,0.65855765,0.3221813,-0.673105,-0.56296444,-0.58305573,-0.19214568,-0.26260754,-0.93173033,0.06650572,-0.051963996,-0.060990445,0.15437323,-0.040150627,0.10495094,0.65733105,-0.99978644,-0.37540123,0.3731837,-0.09419173,0.44662938,-0.629096,-0.68318844,0.8997807,-0.20099728,0.42932624,0.2491124,-0.5136427,-0.43510464,0.96520096,-0.5321856,-0.71418464,0.17159264,0.33338383,-0.28120244,-0.44106105,-0.65980834,-0.1818051,-0.1566914,-0.069694914,-0.9935828,0.7431749,-0.2652242,-0.6499669,0.39425698,-0.593857,0.074702024,0.58374316,-0.2960844,0.52959186,0.23614314,0.99577993,-0.15702946,-0.097652756,-0.027330827,0.14466166,0.1443932,0.9999198,0.023252632,-0.34842575,-0.6347747,-0.24527065,0.7521196,0.32342848,-0.9974476,0.1467827,0.41244936,0.2874324,0.59482706,-0.43255827],
    [150,1,"N#Cc1c(Cl)c(Cl)c(Cl)c(C#N)c1Cl",-0.6164479,-0.006264828,0.30075157,-0.034329183,0.07152735,-0.37957332,0.1797074,-0.011972624,0.27822363,-0.019936098,-0.52785575,0.01920906,0.16414864,-0.15591635,0.398316,-0.7818673,-0.058111627,0.2407775,0.12635235,-0.26928747,0.86762047,-0.36501995,0.84281254,0.28698906,0.17694087,0.7969766,0.14975338,-0.24844337,0.5119445,0.07324093,0.13631961,0.57690847,0.000208388,0.3735844,-0.22879592,-0.37709185,0.20075046,0.122764796,0.9542381,-0.7660492,-0.98260653,-0.10754899,0.22624484,-0.6060336,0.40311787,-0.9817661,0.47984037,-0.017241292,0.9408504,0.0682672,-0.4190042,0.5315082,-0.41786897,-0.07316541,-0.9352678,0.27619016,-0.9080381,0.5790141,0.08908468,0.40483254,0.78808314,0.031487584,-0.4090883,-0.20606966,0.036818728,0.5973546,0.31487542,0.18438607,0.44576544,0.4831978,0.31433418,-0.80475664,-0.34571257,-0.52418995,0.7784754,-0.42733914,0.5603451,-0.73352176,-0.5966124,-0.99378186,-0.3661292,-0.8081626,-0.90813655,-0.06098694,-0.31299144,-0.19842938,0.5309424,0.4975933,-0.1901193,0.020631336,0.23547497,-0.36912766,0.45621154,0.276064,0.9490241,0.35564274,0.5283729,0.40034738,0.27977338,-0.2082461,0.8033238,-0.8227523,0.85161006,-0.9246378,-0.11722931,-0.6537263,-0.19020724,-0.108088575,0.9833331,0.08053965,-0.8461952,-0.2953646,-0.42958122,0.8547249,0.6216627,-0.037017237,0.16897295,0.34767666,0.99964267,-0.7302046,0.56180763,0.44193885,0.21075946,0.25820726,-0.091902934,-0.11554312,0.033899963,0.65886885,-0.106129855,0.99893063,-0.39289397,-0.25201124,0.6839866,-0.32428634,0.5085817,-0.9525961,0.80085206,-0.1632108,-0.7985085,-0.6661187,-0.9980018,0.31984982,0.9817686,0.50664395,-0.09913355,0.35750237,-0.006308394,0.3547804,0.9054734,-0.78507805,-0.24746647,-0.7243216,-0.3250257,0.06657203,-0.3538843,-0.24544759,-0.42585167,0.994294,-0.8273999,-0.95583904,-0.9768183,-0.121260196,0.034165833,-0.07578,0.86234635,0.3419081,-0.2367989,-0.8974107,-0.34265924,0.48938194,-0.8971382,-0.36531332,-0.6456869,0.027360965,0.6057723,-0.70164853,-0.9432968,0.50197405,0.38920107,0.54910195,0.3386112,-0.83138514,-0.3864554,-0.51623213,-0.4312226,-0.27518496,0.575161,0.3925212,-0.5808183,-0.51439196,0.9109101,-0.20804195,-0.21400733,0.07257838,-0.42913237,0.30225265,0.4153774,0.62449366,-0.3505114,0.6721987,-0.7004788,0.5949888,-0.518957,-0.63517547,-0.5940392,-0.635713,0.3968464,0.7687341,0.35753646,-0.9937374,0.67780936,0.04784924,0.6147545,0.12077549,-0.17983717,0.11864214,-0.02491107,-0.51166004,-0.5608674,0.01170841,0.63631415,-0.83869433,-0.39779216,0.13138899,-0.81889516,0.3422649,0.29144424,0.42056367,0.14297268,-0.16330177,-0.014559438,-0.047405794,-0.004816979,-0.5003532,-0.013554628,-0.862463,0.2504789,0.038625658,-0.6135143,-0.25469157,0.7826593,0.7643102,0.87861633,0.1818387,0.1464415,-0.018022133,0.05339031,-0.16223356,0.21884397,-0.6813069,0.04566333,-0.9989471,-0.124983326,0.14751329,-0.87400186,-0.5686246,0.58788526,0.18382418,-0.6903509,0.32158446,-0.4824399,0.42437086,0.07119887,-0.76488197,0.75042295,-0.27462217,0.12530099,-0.29724,0.7347819,0.14165471,0.043675326,0.8660985,0.032871973,0.24289197,0.2904219,0.9340925,-0.5528153,-0.38523698,0.116069935,-0.4723147,0.67525035,0.9991651,0.37417248,0.57731736,0.2584114,0.24042195,-0.3819445,0.7564102,0.91120553,-0.28084207,-0.39251044,0.9985493,-0.40859002,0.9560879,0.1310213,-0.5393253,0.99889946,-0.9686136,0.40895107,0.3686454,0.38340646,0.28304312,-0.55935735,0.19479582,0.07072461,-0.4666773,0.957419,0.5812177,-0.8506457,0.31931582,0.51472163,-0.3654735,0.56290746,0.041126452,0.38402644,-0.17813542,-0.48508704,0.5142376,-0.9999651,0.12217145,0.13879171,0.512109,0.43421558,-0.33614397,-0.5124564,0.085833535,0.75580764,-0.96781516,0.5582165,0.11113694,-0.29102275,-0.010420295,-0.15825191,0.48889905,0.24512498,0.6045834,0.09033412,-0.38954327,-0.45211998,0.7132241,-0.17076549,-0.8442847,0.20401643,-0.64664733,-0.77170396,0.21068904,-0.4854577,0.19907561,0.089393444,0.70568484,-0.9913406,-0.37698436,0.18797645,-0.30336165,0.38067183,0.5884553,-0.11133925,0.9983243,-0.29509062,0.48184645,-0.2512428,0.3390006,0.51444787,0.35366207,-0.7583031,-0.89830256,0.6296048,0.79367864,-0.035356507,0.008646465,-0.545513,0.7100055,0.8137333,0.6777157,0.029475866,1,0.6848153,-0.28969488,-0.10839514,-0.2497401,-0.9395863,0.112852626,-0.6746349,-0.4492459,-0.5279718,-0.3613668,-0.63081545,0.13130331,-0.7585165,0.9087624,0.63553053,-0.4589872,-0.028684622,0.15478142,0.29341868,-0.8815566,-0.11351501,0.26196727,0.9571937,-0.04987778,-0.7779124,0.07045829,0.05195979,0.7331886,-0.5764316,0.30193868,0.18550307,0.55694556,0.28544092,0.2856552,0.8559589,0.5533154,-0.12066801,0.33412328,0.3591236,0.66952854,0.9999999,0.049336016,-0.99047816,0.7461645,0.9991979,-0.8431691,-0.16869728,-0.99996287,-0.64694345,0.7018052,0.7736623,-0.3933033,-0.54413456,-0.32164216,0.38110876,-0.5452837,0.21640213,0.12460687,-0.28723416,-0.49750668,0.5978046,0.14589901,-0.99998814,-0.9987408,-0.99623597,0.39861965,-0.3028499,-0.28597763,0.27400225,-0.70581686,-0.9401996,-0.17575997,-0.19916889,0.5221261,-0.8534233,0.39242053,-0.34349668,0.05679152,0.28062183,-0.1262119,-0.7703404,-0.9243863,-0.99994385,-0.06355163,0.15599816,-0.58919924,0.1300701,0.61877275,-0.9103449,0.55383873,0.46726754,-0.431606,0.1566638,0.5729795,0.3524569,0.92837,0.17255037,0.10300654,-0.6187009,-0.09323727,-0.42584458,0.4158601,-0.44607612,0.47070327,-0.53645116,0.086194955,-0.6303008,0.45780486,-0.68567497,-0.73611766,-0.3184787,0.7066328,-0.6292074,0.8515268,0.13232765,0.792867,0.25096932,0.18169025,-0.43169972,0.43753508,-0.7447577,0.4581047,0.016419189,0.9992539,0.6257589,-0.3884462,0.46585417,0.50476044,0.39423206,0.38762766,-0.6912551,-0.7207305,0.708615,0.94902575,0.6334921,-0.035246246],
    [151,1,"CCOP(=S)(Oc1cnc(C(C)(C)C)nc1)OC(C)C",0.8767367,-0.20319864,-0.6363089,0.47015294,0.6815593,0.088004686,-0.95232964,-0.2710936,-0.36031252,0.057007756,-0.1563399,0.63153416,-0.7222432,0.7034672,0.2992708,-0.84693503,-0.39395186,0.23445053,0.44256675,-0.07946732,0.5350012,0.56701237,-0.62088054,-0.474227,-0.3639769,-0.27092028,-0.52806264,0.37229097,-0.575128,-0.011617672,-0.061795805,-0.2691514,-0.335827,-0.3277319,0.39085987,0.6107533,0.19225477,-0.60046774,0.9968576,-0.7825581,-0.8340095,0.17898236,-0.36241034,0.13241924,0.034659702,-0.64337575,0.028181463,0.2858627,0.9826757,0.21655595,0.702207,-0.16913117,-0.08273071,0.031897143,-0.51495963,0.4969136,-0.6267503,-0.24702528,0.34095287,-0.09642698,0.8090352,0.16128974,0.4802152,-0.11383618,-0.3407697,0.64364433,0.28846037,-0.3416375,-0.07159521,-0.61355275,-0.47270563,-0.92192954,0.26955655,0.34532976,-0.38358074,-0.9031961,-0.10829407,-0.61834574,0.52156174,-0.9998301,0.7641848,-0.67974085,-0.94841254,0.23563021,0.21845216,-0.6989864,-0.42091855,-0.7060744,0.1839495,0.14057748,0.21202512,-0.14765497,-0.55409867,-0.5585905,0.9989408,0.46799642,0.18696615,-0.30492166,0.30135903,-0.6206892,-0.03695471,-0.217174,-0.57665175,0.64134866,-0.971949,-0.9679896,-0.34430543,0.17920047,0.9829563,0.095866,-0.0444463,-0.21955293,-0.57986593,-0.61212134,0.29595685,-0.39915806,-0.27018055,-0.21856211,0.9967323,-0.020794697,0.12239721,0.6622845,0.6068448,0.4566597,0.09387641,-0.0662725,-0.036092736,-0.71864116,-0.24903594,0.9987549,-0.31504628,0.06480684,0.457379,0.21882585,-0.21896882,-0.9916338,-0.5796358,0.14087541,-0.20914409,-0.52375937,-0.9966009,-0.36359376,0.70585054,-0.7681887,-0.4321279,-0.61799437,-0.33909798,-0.46525317,-0.6733845,-0.18044645,0.65912265,-0.87853634,-0.34717166,0.11054694,-0.027721448,0.45017266,-0.27711803,0.7782906,-0.7040552,-0.9542793,-0.87717205,-0.13748212,-0.24116075,0.48192397,-0.040946692,-0.65101933,-0.1612072,0.39395985,-0.48950216,-0.08772823,0.34810078,-0.19066846,0.41971982,0.22359031,0.14915125,-0.69631815,-0.21391274,0.038967352,-0.85292363,-0.009924878,0.0297771,-0.9268594,0.10627487,-0.22767991,0.62274903,0.53017855,0.55989575,0.30943412,-0.06642723,-0.7303625,0.2515777,0.09239204,-0.09004367,0.7075904,-0.69020087,0.6023921,0.09344885,-0.9205527,0.2683176,0.1522474,0.08166743,-0.23754166,-0.25543904,-0.54294974,-0.73398936,-0.30418324,-0.45432618,-0.7574553,-0.43012965,-0.9997632,-0.75387216,-0.5310256,0.102451995,0.69652367,0.6845379,0.24823505,-0.4992355,0.455365,-0.583712,-0.004970227,0.039523996,-0.4998544,0.5689902,0.37554398,-0.99209327,-0.14741649,0.076960295,-0.7928236,0.30825192,0.75125027,-0.6848676,0.46029127,-0.20454532,-0.5097817,-0.059484567,-0.22319318,0.48878095,-0.33719116,0.25075352,-0.5573035,0.79886776,-0.46593678,-0.053312637,-0.45703557,0.1484441,-0.87977165,0.5778134,-0.17584302,0.061065502,0.673456,0.57408935,-0.99790174,0.22118822,0.33795032,-0.2218046,-0.6119747,0.39119464,0.20351405,-0.35814047,-0.32480094,0.21734121,0.17754108,0.31856206,0.7867899,0.08486877,0.01946576,-0.6178526,0.5004578,0.50985575,0.09895555,0.34837094,0.9986536,-0.4246818,0.13769798,0.112955004,-0.7922371,0.49659488,-0.49399722,-0.040765002,-0.5220337,0.33911887,0.99731016,-0.6743971,0.060952023,-0.45972797,-0.42042294,0.4853423,0.7423694,0.835662,-0.7629931,-0.44042084,0.9814803,0.5509511,0.81944627,0.49330547,-0.6283855,0.99765915,-0.96413493,0.15470071,0.2954373,-0.40678334,0.6790603,-0.5015127,-0.25890934,0.5116955,0.5128439,-0.48628768,0.6737411,0.4658601,0.19862218,0.22535723,-0.026354551,-0.647561,-0.42864904,0.12944666,0.51374406,0.11505319,-0.06739492,-0.9999539,0.093767814,-0.5838053,-0.8200829,0.5281099,-0.8869596,0.38810378,-0.33448094,0.21542186,-0.37894678,0.39943632,0.5077337,-0.07181879,-0.55707467,0.46883118,-0.12437743,-0.15224487,0.19306144,-0.15864764,0.25423166,-0.054648355,0.5679042,-0.39851904,0.33791894,-0.38949633,0.13855575,0.3781241,0.40113822,0.27371457,0.81368047,-0.40440193,-0.5146918,-0.92799604,-0.43067497,0.043046825,-0.22450225,-0.778132,0.0674313,0.8661376,0.9998197,0.3293704,0.15979214,0.24102983,0.3731305,0.62629455,-0.8591024,-0.117695786,0.13412516,-0.27080336,0.19178586,0.7368778,0.6393448,0.20000254,0.61017364,-0.02506337,-0.46339238,-0.050775886,1,-0.18392302,0.45508033,-0.59849745,-0.057566762,0.003110726,-0.027786022,-0.08544895,-0.2567304,-0.6727716,0.2225237,0.28136936,0.3606988,-0.84540135,0.4154787,-0.44460338,0.062234588,-0.26930988,-0.14153695,-0.46594757,-0.893232,-0.2250692,-0.5977168,0.13955319,-0.38644215,0.64523286,-0.37189144,0.80769354,-0.43211365,0.80671996,-0.29551947,-0.24763115,0.06281615,-0.22196276,-0.046434354,-0.8043273,0.7149104,0.15642957,0.29430783,0.15115112,-0.062990464,0.99999976,-0.37175354,-0.9898132,-0.63822246,0.9985889,-0.6448211,-0.19403607,-0.9999296,0.034692615,-0.83195364,0.010368012,-0.5160506,-0.09861601,0.71689886,-0.5801422,0.28629425,-0.3390799,0.7969442,-0.6245172,-0.7903073,-0.1661461,0.072533675,-0.99993676,-0.9936428,-0.8524958,-0.16277511,-0.09653102,-0.48001498,0.47214097,-0.017640112,-0.2236624,0.50111645,0.4854505,0.10520933,0.22443962,0.20434377,-0.23522198,-0.79354775,0.9005385,0.61800444,-0.098970145,-0.09153399,-0.99984556,0.7624747,-0.2885319,0.81976604,-0.11856412,-0.7446194,-0.5790876,0.8114703,0.5227129,0.13398388,-0.29738265,-0.9002524,0.329542,0.95601976,0.18110652,0.25201666,-0.68420243,-0.35229632,-0.5014462,0.5057455,-0.044475704,-0.1227423,-0.6862698,0.5068274,-0.9857782,-0.38541836,-0.06965041,0.014824134,0.1120152,-0.1388811,0.038766786,0.6921795,0.5258938,0.16264226,0.18722796,0.96374345,-0.06450076,0.43982738,0.57834333,0.44064617,-0.030687567,0.9998584,0.87696606,0.19147766,-0.41124302,0.1448342,-0.511092,-0.085592836,-0.99114794,-0.5407925,-0.24412985,-0.13419342,-0.6358491,0.24742644],
    [152,1,"Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O",-0.24623394,-0.2356667,-0.006706134,-0.4070292,-0.6104398,-0.19721349,-0.71136737,0.22239532,0.49302536,0.43550593,0.24549784,0.28406712,-0.17793809,0.40251985,-0.48453608,-0.110045835,-0.4434582,-0.1199098,-0.60551816,0.65254205,0.8251761,-0.37463158,0.13385305,0.63947475,-0.41939053,-0.14642243,0.25519374,0.35721874,-0.3929553,-0.46442154,-0.1192388,0.34003466,-0.48806107,0.33131093,0.38961554,-0.42279807,0.5338981,0.62806714,0.8704128,-0.31130716,-0.99237424,-0.15420301,0.27861735,-0.30563593,-0.443692,-0.98936,0.35072985,0.4949548,0.9611841,-0.58079535,0.15367492,-0.02622909,-0.64594686,0.412758,-0.82522196,0.17544653,-0.80000544,0.67185,-0.15458623,0.3432638,-0.28182673,0.046149123,-0.2353396,-0.4553269,0.061354224,0.75081366,0.627126,0.4213609,-0.12910849,0.43510103,0.22991636,-0.99693024,0.32686383,-0.2133314,-0.41521206,0.6041622,0.1795955,-0.22963789,0.20150101,-0.99906355,0.026185058,-0.3899741,-0.94098693,-0.34568274,-0.22250833,0.65229774,0.2571612,0.35315138,-0.81650466,-0.15185787,-0.4570672,0.07263306,-0.29782104,-0.2551764,0.99875236,-0.5384681,-0.39119548,-0.33760858,0.46901646,-0.17193487,0.47583732,-0.19360384,0.51837814,-0.7427655,0.12476835,-0.8649759,-0.23390624,-0.39460668,-0.89606935,0.3818063,-0.15170293,-0.6029477,-0.5264039,-0.42230043,0.31011042,-0.40856147,0.20420705,-0.35958147,0.9997524,-0.77611476,-0.0889353,-0.4511643,-0.10330034,-0.73943216,-0.5398385,-0.47749582,-0.17204504,-0.11124534,-0.08729023,0.98095375,-0.23788394,0.35616174,-0.3183748,0.29026514,0.01003535,-0.44252324,0.72929466,-0.2829079,-0.7363066,-0.46475247,-0.99855864,0.6361451,0.46427596,0.043509826,0.041116055,0.105064735,0.42308894,-0.4111573,0.9358148,0.2590124,-0.09353933,-0.31419423,-0.71778435,0.14694318,-0.3349885,-0.5258245,0.012682203,0.9922273,-0.6565048,-0.9139792,-0.99194604,-0.5691357,-0.056266237,-0.3065863,-0.1060903,0.5451925,0.16168138,0.394973,-0.20017283,0.5856146,-0.6784843,-0.21867889,-0.29167718,-0.70645,0.6357301,-0.92153054,-0.89451355,-0.12583764,-0.0924227,-0.013801223,0.68775886,-0.99964285,-0.55173683,-0.38924664,-0.331536,-0.23131488,-0.37097558,0.39608377,-0.6769307,-0.61304665,0.878865,0.6957181,0.4422699,-0.15741791,-0.4179335,-0.106166266,0.31209645,0.9780638,-0.5346307,0.41486937,-0.24261568,0.27781737,-0.07717823,-0.18934926,-0.63218284,-0.60198003,0.6618422,0.59556645,0.020410588,-0.98400736,-0.061391227,-0.21018538,-0.0586635,-0.355629,0.41439006,0.35284132,0.6624303,0.32313132,-0.417831,-0.30480298,-0.09601408,-0.40760684,0.33997792,0.3883634,0.98840344,-0.076174505,-0.42661056,0.69017285,0.3461846,-0.59765106,0.25414774,0.22972786,0.44812208,-0.3540178,-0.7478422,0.13774711,-0.14771044,0.11889527,0.49154335,0.16448663,-0.005556552,0.466926,0.66627514,-0.3530714,0.5708173,-0.24257803,0.050944205,0.56646407,-0.22233272,-0.42260742,-0.23276882,-0.9989429,-0.07686799,-0.07247615,0.0349594,-0.38793927,0.041807458,-0.14584106,0.37693164,0.021498809,-0.7913923,0.6411951,0.28845808,0.30115935,0.57598734,0.09611929,0.06861939,0.5348724,0.3371015,-0.005382765,0.26647052,0.3596452,0.5127988,0.1264673,0.060845375,0.49503675,-0.09775639,0.21994309,-0.22321032,0.33559406,0.38773298,0.99941826,-0.65274614,0.47189745,-0.34373102,0.36239275,-0.09691493,-0.36845765,0.049357552,-0.22613813,0.29748783,0.9989463,0.3434879,0.92872477,0.020328203,-0.19131178,0.99935895,-0.22648624,-0.61784947,0.3299777,0.4227354,0.80198365,-0.78691083,0.49139595,0.023436813,-0.474308,0.9638699,0.11009488,-0.4392981,0.2164603,0.35145542,-0.05724954,0.5664829,-0.41532865,-0.9703717,0.197183,0.64389414,0.31073257,-0.9945748,0.3416219,0.23939213,-0.008134262,0.32415748,-0.8120451,-0.07115778,-0.25475058,0.5471298,-0.7722883,-0.53145146,-0.44625488,0.49406797,-0.34741613,-0.33886132,-0.26708454,-0.27961612,-0.8845934,0.01233814,0.22723968,-0.45748842,0.36995706,0.5543738,0.09627169,-0.7365134,-0.09401407,0.35276833,0.3274723,0.40412796,-0.7211505,0.30563056,0.75946,-0.986554,0.47937885,-0.5075205,-0.35899997,-0.0852601,0.5075198,0.29607838,0.99940646,0.21320592,0.61414874,0.5424605,0.33274585,0.41933984,-0.34379065,-0.10041765,0.35831857,-0.08148464,0.111727476,-0.22837336,0.2468176,0.19123058,0.099623136,0.7258884,0.7658402,-0.18835448,1,-0.32743102,-0.45045903,-0.33626407,-0.109861165,-0.83516973,-0.029516065,-0.5600365,-0.8188829,0.39393803,-0.26617593,-0.32382527,-0.58942896,-0.47328553,0.8510922,0.48073328,-0.36555594,0.2150687,0.22760007,-0.33340326,-0.79173756,0.65096724,0.76091665,0.91948617,0.8309807,0.8722642,-0.48979375,-0.36013365,-0.67231387,0.21766356,0.051217563,0.25822732,0.9978811,-0.12914875,-0.5448165,0.62333727,0.3927654,-0.23464128,0.44176915,0.5985027,0.12999725,0.99999,-0.2040905,-0.99041426,0.3591565,0.9987084,-0.20098056,0.13349834,-0.99899876,-0.83537006,0.46567604,0.7027198,0.21357241,-0.60400313,-0.27959853,-0.47955158,0.6315687,0.34267613,-0.7765719,-0.17864676,-0.092671126,0.13878305,-0.25236002,-0.99997103,-0.99932444,-0.9940958,0.31156397,0.013039588,0.80647147,-0.22847563,-0.47083455,-0.86026424,-0.41962957,-0.2797816,0.3054551,-0.8920848,0.18211718,0.29007426,-0.21577251,0.08530372,0.005907713,0.067212015,-0.96617717,-0.9999765,-0.058974374,0.34601787,-0.5734068,-0.32624772,-0.09497787,0.6302086,0.8587408,-0.63578707,-0.6247391,0.2037225,0.08150122,-0.5350078,0.962971,0.5218907,0.4296114,-0.53212166,0.21352747,-0.015229782,0.38413697,-0.095990814,-0.07115724,-0.035587672,0.9332963,-0.41458488,-0.48716816,-0.62400335,0.12080171,-0.26719344,-0.26511157,-0.4246226,0.7792773,-0.6132009,0.57101166,0.6885998,-0.21537589,0.14894627,-0.2649598,-0.73284024,0.76982766,-0.6768604,0.9984872,0.59492296,0.005507174,-0.77202314,0.15064183,-0.23597895,-0.4511254,-0.51607305,-0.22291526,-0.7240874,-0.21809286,0.7689176,-0.32929096],
    [153,1,"Cc1nccn1-c1ccc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)cc1",-0.73894656,-0.27715364,-0.17094631,-0.7132069,0.33908787,0.34071675,-0.16569573,-0.14071795,0.13987395,0.40271217,0.11988863,-0.06630824,0.40867877,0.1802152,0.6116016,0.48977563,-0.72431874,-0.11007634,0.2645571,-0.33726317,0.66437054,0.44105688,-0.26941782,0.045090213,-0.47913948,0.8262484,0.038405593,0.75573766,-0.33260825,0.028901245,-0.63771254,-0.3674215,-0.30650434,-0.5049497,-0.6118832,-0.40834194,-0.7897209,0.44012886,0.9993569,-0.18267035,-0.7342197,0.2510908,-0.13578251,-0.06850774,0.41808233,0.4847935,-0.428123,0.8102413,-0.43912524,-0.5230269,-0.019693099,0.6506942,0.23168422,0.45613202,-0.36833602,0.11370206,-0.23309834,-0.8573779,0.22506513,-0.58490354,-0.3758586,0.005179766,0.44530934,-0.36616665,0.2835172,0.46597484,-0.36485243,-0.013005361,0.06729424,0.12969919,-0.947834,-0.9113113,-0.2331827,-0.72980464,0.6160817,0.5210094,0.78176194,0.12188633,0.33974892,-0.9993363,0.21025036,-0.53308845,-0.9693433,-0.8313712,-0.57578975,-0.9246754,-0.58889276,0.59715515,-0.92928654,-0.07619382,-0.17682916,0.1737181,-0.5569192,0.029583503,0.9967509,-0.63572097,0.5140779,-0.66753775,-0.3324155,0.5500995,0.20157887,0.58506197,0.6816628,0.9892032,-0.99890023,-0.49407914,-0.43833107,-0.42836508,-0.9406859,-0.5165562,-0.23702368,0.16733071,0.6185478,0.09629057,-0.43324754,-0.22053085,-0.15120983,-0.5747692,0.8856537,0.38146937,0.2384702,0.7611171,0.42708313,0.257045,0.120303765,-0.26584402,0.16604348,0.030430557,-0.14816196,0.9994548,-0.6062142,-0.008203627,0.56151766,0.67922825,0.504549,-0.97078955,-0.4925476,0.55232686,-0.16906375,-0.008335112,-0.9999996,-0.019816294,0.28083047,0.21202472,-0.20928638,-0.10809309,-0.09487157,-0.30891356,-0.98888123,-0.53769964,0.4954352,-0.61430144,0.07218474,-0.021711413,-0.35625726,-0.11762671,-0.68039787,-0.84805626,-0.3572446,-0.50232136,-0.27775726,-0.61681473,-0.5085014,0.60362697,-0.09207179,0.40569243,0.20227067,0.027111283,-0.5275379,0.35134637,-0.18961638,-0.100028835,-0.34624147,-0.5481423,-0.20925368,-0.815235,0.4916672,0.07076733,-0.37861478,-0.15364823,-0.27701584,-0.9076345,-0.7962478,-0.452983,0.55595005,0.03775283,-0.5879059,0.6268804,0.65706635,0.12178645,-0.153889,-0.3759253,0.4315653,0.24113755,0.06962654,0.5395859,0.11778661,-0.278953,0.32851216,0.20311691,0.7333298,-0.6947513,0.62017375,0.56109655,0.593237,0.13213755,0.54045755,-0.7020805,-0.50114423,-0.9998191,0.3261147,-0.1234007,-0.56762844,0.238716,-0.54607904,0.35906702,-0.31212616,0.37460774,-0.1717825,0.17308247,-0.5521307,-0.38388354,-0.26322544,-0.5173001,0.985703,-0.03123629,0.7603566,0.432287,0.041489888,0.25143552,-0.09565911,0.45567122,-0.39234757,-0.2621271,-0.12848455,-0.3965461,-0.0822418,0.4200781,-0.261446,0.07008794,0.8489175,0.101034984,0.23529178,0.03718877,-0.022618728,-0.25019976,0.0652096,0.19660538,0.43224612,-0.3149108,0.18539587,0.27158558,-0.2857463,0.050033197,0.69437957,0.33297375,-0.28720173,0.5936561,-0.12220405,-0.40908605,0.4115932,-0.34278882,-0.4916762,-0.13955389,-0.31384787,-0.18267581,0.42442796,-0.38704252,0.6708788,0.3559876,-0.4554744,0.9981726,-0.18224199,0.50870514,-0.4234342,0.3588391,0.9202109,-0.77970713,-0.5239569,0.058001116,-0.16857833,0.9833186,0.18358147,0.5695217,-0.23401837,0.5983293,-0.03561008,0.6506371,-0.43187422,-0.45920232,0.46660098,0.18288486,-0.3303245,-0.26411247,0.14767171,0.1335118,0.9999999,-0.97282076,-0.6173762,-0.35128015,-0.40069422,-0.6618175,-0.39865494,0.10981975,0.6110745,-0.29644775,-0.99733496,-0.55614954,0.83664775,0.3222505,0.42067835,0.55371314,-0.5727236,-0.027589263,0.26263672,0.23232082,-0.38069716,-0.47816387,-0.9080831,0.061844,0.39699826,0.1244909,-0.54604185,-0.5778139,0.02590128,0.13839991,0.5162211,-0.5211231,-0.56107646,0.21840021,0.584533,-0.8034559,0.53817344,0.69159746,0.11828606,0.30238295,0.18419497,-0.056375094,0.0954913,-0.718256,-0.32481548,0.07127727,0.5396568,0.0313206,-0.237776,-0.7970105,0.007219959,0.10713487,-0.029450918,-0.95171493,-0.73174685,-0.15308034,-0.42617136,-0.50540286,-0.4144009,-0.17842104,0.21559049,0.999537,0.79432636,-0.7604241,-0.19732721,-0.17432563,0.64040536,0.13517982,-0.7846919,-0.6420495,-0.32058063,-0.58668905,0.2989726,-0.4882008,-0.3182323,0.8299874,0.20818795,-0.7066338,-0.22275735,-0.9999999,-0.72599465,-0.6862937,0.2731331,0.24031514,0.6445786,-0.24035102,0.40511855,-0.51143163,0.15845065,0.46049163,-0.065525964,0.6844198,-0.38314012,0.120252006,-0.29380387,-0.88702476,0.51113725,-0.34241763,0.33564806,0.5537464,0.13555059,-0.31394908,-0.42311975,-0.5029432,0.884403,0.5545204,0.10374054,-0.2998904,0.2690562,-0.6631041,-0.4501153,-0.78598267,0.25531787,0.6260972,-0.07475031,-0.30989704,0.21401358,-0.63851714,-0.44073394,-0.44380748,0.9998496,0.6473316,-0.9462459,-0.26717147,0.9984219,-0.09729061,-0.045230128,-0.998955,0.30471414,-0.71002066,0.55464375,0.117525406,-0.7047201,0.29264495,-0.38560456,-0.24871917,-0.29078716,-0.018573334,0.404516,-0.022680612,0.28309384,-0.48052296,-0.9999148,1,0.7452935,-0.28122532,-0.196262,-0.85971165,-0.19161515,-0.35636297,-0.21410874,0.18646052,0.5909114,0.15368247,-0.91496015,-0.544877,0.3987423,-0.7109485,-0.32708827,-0.10234265,-0.113538496,0.95104474,-0.9991828,-0.07034831,0.35957697,-0.49420047,-0.91895235,0.66531646,-0.71834475,0.7491642,-0.4826234,-0.74479365,0.47668266,-0.14993651,-0.44240808,0.9855962,-0.6208538,0.7926547,0.37429768,-0.014648884,-0.13593154,-0.16303355,0.24684551,0.5659262,-0.5668143,0.043738604,0.15181789,0.60858667,-0.12255536,-0.69140166,0.33380982,-0.5036773,0.35941285,-0.6227036,-0.25067714,-0.1571497,0.47280267,0.999,0.61863196,0.03890702,-0.2007809,-0.20609006,0.37368402,0.999556,-0.024856785,0.4329231,0.40090987,0.48019528,0.6780752,0.03714151,-0.99880165,0.34389463,0.57801056,-0.5949213,0.22945762,0.44076753],
    [154,0,"ClC(Cl)(Cl)c1ccccc1",-0.6796036,-0.40029326,-0.31182808,0.71361566,-0.42152128,-0.57250136,-0.6874278,0.20677717,0.29144484,-0.75974554,-0.61661494,-0.025089059,-0.54412353,-0.501498,0.3745456,-0.27865884,-0.26786375,0.51310384,0.15506284,0.112210855,0.39458898,-0.88393104,0.19815136,-0.16710286,0.233478,0.605705,0.13141258,0.1832047,0.8147294,-0.18680093,0.14710054,0.69916177,0.060960263,0.19519621,0.18772778,0.23216589,0.37708125,0.871493,-0.4757341,-0.9821974,-0.9977383,-0.25770527,0.16298975,-0.032607112,0.059999745,-0.9969699,0.22117193,0.32099625,0.9987493,-0.35672477,0.06169042,0.34994075,0.051590662,-0.5866534,-0.9856542,0.3089248,-0.60837805,0.9621271,-0.03485351,-0.17807636,0.27302754,-0.46607056,0.4146214,0.43776184,0.22475024,0.59632695,0.39782807,0.51710486,0.10183864,-0.13628915,0.9479848,-0.84474504,0.08686424,0.60376906,0.74754804,-0.36153802,0.34471992,-0.30899987,-0.30416682,-0.99634296,-0.56473225,0.12802383,-0.3169801,-0.4497147,0.35968992,-0.16450875,0.33410776,-0.20778766,-0.7689061,0.2976956,0.4055366,0.20335662,0.3824222,0.12876502,-0.5452062,-0.07512447,0.47230697,0.12483569,0.37918448,-0.6128347,0.5763547,-0.4258779,0.6447353,-0.49474534,0.96547145,0.60629755,0.26092094,0.51338995,0.9917036,-0.1351769,-0.14747368,0.04859695,-0.36277768,-0.44105262,-0.29194275,0.55778354,0.1991269,0.5625856,0.9992374,-0.1258417,0.39616698,0.23815702,0.10147569,0.02634375,-0.018796634,0.24086565,-0.45371696,-0.045015603,-0.6995695,0.9998246,-0.030431235,-0.015233372,0.5274907,-0.54924184,0.507198,-0.7000563,0.49110425,0.4239924,-0.44907716,-0.12638432,-0.9954416,-0.2765701,0.9983956,-0.13055727,0.4854289,0.30339405,0.24107857,0.17911673,0.9959801,0.10667276,-0.58123136,-0.2981906,0.4294679,-0.18465726,-0.68135786,-0.43507838,-0.08116427,0.9995498,-0.2633665,-0.9407782,-0.9879538,-0.17030004,-0.18734077,0.61202127,0.36344424,0.22730051,0.5310316,0.55391395,0.0156576,0.18366228,-0.88960207,-0.11965641,-0.34607434,0.007035119,0.19348985,-0.97526115,-0.8466999,0.35338977,-0.04762272,0.095424324,0.17275392,0.87585986,0.16795817,0.114636004,-0.9521593,0.1391957,0.69119513,0.083178595,-0.10517507,0.07437069,0.44924608,0.30712017,-0.028029595,0.3666999,0.111913495,-0.16187283,0.6015572,-0.77438265,0.8063485,0.5352436,-0.25406045,0.3943192,-0.85392565,-0.30769613,0.6765683,-0.10276704,0.4879364,-0.23046869,0.24048229,-0.6447727,-0.5580803,-0.019266218,0.44469047,-0.065100014,-0.20008922,0.13890536,-0.00810458,-0.5620604,0.17023604,0.13606122,-0.012587081,-0.53083587,0.081494465,-0.41085657,-0.9704536,-0.014877134,0.17590025,0.17963193,0.5121372,0.5800483,-0.31147403,-0.043097075,0.39414576,-0.6212117,0.5372467,-0.6155729,0.1601287,0.57783633,-0.66187483,-0.17221293,0.87096065,0.14542979,-0.18303226,-0.5356526,0.30899236,-0.40182415,0.26192117,-0.40785778,0.09255238,-0.43809545,0.022985965,-0.99659425,-0.45985642,0.6696899,-0.012592185,0.02424215,-0.3656775,0.179157,0.40265372,-0.6091785,-0.35306668,0.30819064,0.02866129,-0.57645625,0.19427288,0.047474846,0.32518098,0.44293585,0.7778712,0.21991706,-0.6123632,-0.5889662,0.20669545,0.24168877,0.24942625,0.93707013,0.13720316,-0.8335716,-0.22020315,-0.3279196,0.17409368,0.9994374,0.019349596,0.7906106,0.073681496,0.18079427,-0.68520373,0.5862405,0.9672034,-0.6072528,-0.008621091,0.99966896,0.37872526,0.5811352,-0.14608453,0.11422628,0.995301,-0.9860276,0.33778346,0.18103224,-0.21313645,-0.40979183,0.295245,0.17359534,-0.012949113,-0.37339824,0.9991808,0.67008907,-0.37067664,0.101512074,0.12560686,-0.5032249,-0.15214719,0.04174802,0.97456765,-0.7118661,0.051184144,-0.13210607,-0.99997663,0.033837825,-0.26365247,0.56123096,0.7190647,-0.6472906,-0.67315274,-0.88626194,0.5323105,-0.9795858,0.17953824,0.56301665,-0.2089247,0.10825667,-0.21333143,-0.21959744,0.41422218,0.8883443,0.21768841,0.11043853,-0.6336613,0.36803326,0.05196276,-0.8349942,0.21821424,0.68595177,0.003855153,0.3199339,0.021023113,-0.02954625,-0.5040242,0.96424055,-0.99721795,0.11074553,0.11128363,0.050786696,0.45068744,-0.010951809,-0.087803654,0.9916828,-0.48268119,-0.15880135,0.16423875,-0.45073062,0.39472863,0.18007861,-0.8599392,-0.21299013,0.3940797,-0.48724592,-0.46905613,0.37404084,0.34785122,0.14188431,0.35521448,0.9795702,0.35317406,1,-0.5695734,-0.5108777,-0.27688304,-0.42739564,-0.9583988,-0.27055356,0.0577041,-0.3720864,0.02558023,-0.12946136,-0.10210859,0.108102635,0.008630403,0.55868655,-0.068747714,-0.056544814,-0.083334945,0.52319664,0.20021005,-0.45039567,-0.31188112,-0.25073996,0.85231286,-0.6600289,-0.99277025,0.54712576,-0.2075979,-0.021731844,-0.21159324,-0.4348878,-0.73333925,-0.30687612,-0.023980191,0.2915081,0.8207663,0.55931354,0.21870759,0.41572702,0.34698305,-0.040310606,0.9999997,-0.001302187,-0.99461204,0.15958165,0.9967779,-0.7761591,-0.29236647,-0.9998861,0.048735324,0.6541419,0.5788154,-0.039431695,-0.5822419,0.5227672,0.15987773,-0.02212915,-0.5523108,0.029691545,-0.44331196,-0.45698205,-0.21419744,-0.3664972,-0.9999751,-0.99964166,-0.99701935,0.40863946,-0.1282724,-0.2774894,0.3324167,-0.5335848,-0.85075474,0.59863937,0.26965255,-0.49290803,-0.7238597,-0.030263484,0.45606714,-0.19597724,0.065412365,0.19685823,-0.5887074,-0.9919003,-0.99989784,-0.20734653,0.39923936,-0.3019051,-0.02110683,-0.2789263,-0.99897003,-0.5915992,-0.019324994,-0.05593239,0.09494604,0.19568023,0.5570716,0.8451833,0.47100994,0.8910055,0.1559518,0.245047,0.392292,-0.81488997,-0.5316573,0.37877065,-0.61425173,-0.58576703,-0.9144601,-0.32962927,-0.03746308,-0.6894393,-0.27809504,0.20678341,-0.2694743,0.5848093,0.085874535,-0.23468927,-0.046739414,-0.9661133,-0.07342951,-0.28493935,0.16615993,0.10709275,0.32169318,0.996728,0.516681,-0.1476833,0.43870315,-0.015898881,0.09622562,0.23191424,0.8421814,0.10602898,0.32339305,0.49597892,0.66200334,0.06824039],
    [155,1,"FC(F)C(F)(F)OCC(Cn1cncn1)c1ccc(Cl)cc1Cl",-0.22502369,0.4115343,0.20204633,-0.37991107,-0.09701373,-0.3659989,-0.20944813,-0.42882636,-0.08726675,-0.4777853,0.119432904,-0.59123045,-0.39418656,-0.040014155,0.74178004,-0.80737406,-0.45742694,-0.28453928,-0.4966965,-0.44799635,-0.2646818,0.033601813,-0.2905944,0.13926515,0.4187641,0.080875866,0.44611275,0.09140167,0.70856506,-0.14235286,0.3072547,-0.005913002,0.50757235,-0.046308696,-0.067130834,0.7016676,0.2590692,0.13376997,0.9980456,-0.73642516,-0.06539368,0.42619166,-0.24776904,-0.18945003,-0.8640941,-0.46478483,0.10134815,-0.3135194,0.94961005,-0.48082012,0.64925534,-0.039238587,-0.50574774,-0.41203183,-0.5979178,-0.3344789,-0.43103537,-0.14418902,-0.22223927,0.44431737,-0.6600582,0.063598335,-0.07540854,0.3060475,-0.72249776,0.11797075,0.5534907,0.16464029,-0.1677943,-0.112709425,-0.85928315,-0.681365,-0.051862247,-0.028319413,0.64465344,-0.71477395,0.2568967,0.24826425,-0.30266088,-0.9994952,0.32841852,0.094508424,-0.94020414,0.4225109,0.4174642,-0.8682003,0.051870156,-0.5031773,-0.5828776,0.73742217,0.5998987,0.5692543,0.008164167,-0.001649149,0.9871875,-0.00723774,0.47786754,-0.66612995,-0.4731571,0.53247845,0.1589492,-0.56019515,-0.450271,0.94909513,-0.9874672,-0.8769224,-0.59282607,0.55041635,0.9777095,-0.2212287,-0.17240551,-0.117679864,-0.56263417,-0.2476707,-0.064715035,0.60745174,-0.023223579,0.86369026,0.988869,-0.38435495,-0.52871764,0.08500192,-0.04518992,0.30769747,-0.44805154,-0.20409356,-0.37541887,0.43394345,0.03159681,0.9995962,0.8153981,-0.1226332,0.60891205,0.1423401,0.12943117,-0.9923733,-0.23289576,-0.5234225,-0.1497925,-0.34315094,-0.9998235,-0.475157,0.9181198,0.29111162,0.54849243,0.6568231,0.018051123,-0.2983833,-0.9140481,-0.30889428,0.050731707,-0.7783305,0.08093486,0.42812052,-0.37740368,-0.27141812,0.4188283,0.3506,-0.27786392,-0.95708543,-0.7429094,-0.41883275,-0.5722985,-0.68555534,-0.59720683,-0.19646429,-0.5185703,0.03993947,0.120370984,-0.62497354,0.04410214,-0.029172316,-0.44514367,0.21951355,0.30187386,-0.29036877,-0.7161292,0.53560656,-0.2212041,0.8469292,-0.2715911,-0.17935655,0.17705141,-0.41972485,0.45064786,0.48376912,0.37902576,0.59955376,-0.716594,-0.14530316,-0.4231727,-0.5214307,0.07521572,-0.18601899,-0.5393066,0.41159043,0.50075436,-0.7706556,0.5020087,0.70090437,-0.43685573,0.248478,-0.5558961,-0.73470306,0.095013596,0.08256567,0.67453283,-0.21862002,-0.5537487,-0.99991566,-0.07530473,0.54217714,0.2560396,0.23702756,-0.7521776,-0.038903955,-0.040666666,0.38003662,0.34206024,0.008872388,0.383058,-0.025483744,0.60283756,-0.07859103,-0.9818027,0.37378746,-0.12534037,0.18811119,0.6132124,0.5106348,-0.505612,0.11946948,0.050812878,0.722022,0.65563065,-0.20411342,0.7608739,-0.56963456,0.55853,-0.6332554,0.8872649,-0.038508892,0.2829225,-0.22942913,0.001477052,-0.44952023,0.18033046,-0.33218586,-0.55235296,0.8030739,0.22159722,-0.978022,-0.14354247,-0.059142593,0.08776329,-0.29454216,0.1264037,-0.03355026,0.1425126,-0.7061816,0.48965606,-0.6075894,0.40965143,-0.12415681,-0.25269985,-0.39464328,0.08919272,0.32002515,0.9309443,0.07604904,-0.15451987,0.9990288,0.29595083,0.7058113,-0.3312133,0.7494844,0.042367805,-0.7355633,0.16218767,-0.7791273,0.500621,0.9961856,0.080206804,0.648352,0.30738363,0.64515346,-0.018047512,0.9154992,0.85614824,-0.5924085,0.05992985,0.96313304,-0.36314487,0.19065821,-0.10618753,-0.6424447,0.99989927,-0.9919168,-0.18673903,0.63748777,0.4057306,-0.1719458,-0.11601725,0.29797757,0.7819717,0.32028228,-0.9336959,-0.16863795,0.7498849,0.5096953,0.19464709,-0.45635307,-0.21588324,-0.07440256,0.79338735,-0.1961348,0.10352962,0.63582903,-0.99992645,-0.41787663,-0.68517303,-0.20219299,0.5280037,-0.34317574,-0.18706085,0.15048099,0.17836466,-0.37605372,-0.38584334,0.064121135,-0.63656086,0.21740846,-0.50786984,-0.02498278,0.053570516,0.7822022,0.00216311,0.7745563,-0.43518826,0.22010188,-0.3830634,-0.4830665,0.36921564,0.113163404,0.5879421,-0.22026205,-0.7260153,-0.1753276,-0.47585788,-0.53368556,-0.9167766,-0.13556767,0.7351479,-0.10363194,0.13912593,0.8880592,0.6583407,0.99985325,-0.7257791,0.051907353,-0.6409347,0.31541035,0.40575236,0.4244692,-0.6733525,0.059892587,0.6868144,-0.055235032,0.3662773,-0.27258375,0.19644204,-0.38593903,0.024299843,-0.44122759,-0.08015696,0.9918576,-0.60003066,-0.6958858,0.36888525,0.08848312,-0.18810889,0.025543332,0.18160263,-0.253807,-0.009023051,-0.19329938,-0.56032693,0.5349436,-0.07281128,0.024779122,-0.13573323,0.678402,0.23197363,0.5289237,0.35040355,-0.7774393,-0.2561395,-0.43118316,-0.20157781,-0.6505345,0.30457965,0.18998495,-0.022658342,0.429424,0.48049402,-0.023396315,-0.69382834,0.14880282,-0.2932918,0.38426864,0.34406593,0.053298626,0.3929556,0.000754759,0.53567505,-0.37797263,0.9999997,-0.40021494,-0.96966815,-0.4185756,0.9990153,-0.88090616,0.733743,-0.9999288,0.49428287,-0.64610213,-0.65102243,-0.64428234,-0.53656495,-0.30809575,0.25830257,-0.28638092,0.12632342,0.1498265,-0.78755426,-0.55243146,-0.50355774,-0.38295928,-0.999973,0.9951046,-0.45907378,-0.17234685,0.12247384,-0.22137927,0.6310605,-0.36658207,0.11298797,0.039308812,-0.4188201,0.6822309,-0.3945677,-0.01986807,-0.79099,-0.14788474,-0.39084145,0.2830009,-0.47545177,0.31857878,-0.9995863,0.59143126,-0.01996798,-0.43984342,-0.15330635,-0.11116143,-0.8954994,-0.1950766,0.05582928,0.16939624,0.3387702,-0.31160143,0.37223852,0.95213807,0.14960778,0.32438573,-0.2946938,-0.16791824,-0.09391587,0.13750105,-0.5908782,-0.5503113,0.053178303,-0.22062162,-0.8978094,-0.24838959,0.20764948,0.3733886,0.22804706,-0.52322704,0.582119,0.6516385,-0.4219862,0.75255674,-0.025758576,0.9947528,0.5600396,-0.043635447,0.35220578,0.2895465,0.28775936,0.9996579,0.8029605,-0.32815254,-0.24055605,-0.23620519,0.037185438,0.6083881,-0.99662834,-0.08341227,0.36063385,0.54693294,-0.5471203,0.06894825],
    [156,1,"CCCCCCCCCC(=O)O",-0.7567904,0.109667644,-0.7939426,0.4677857,-0.01540114,0.03570224,-0.003147873,-0.11499548,0.36236325,0.34082478,-0.68419284,-0.080290206,-0.025779609,-0.6786209,0.48755777,0.5138067,0.40241805,-0.26022527,0.065202676,-0.3906165,0.48621818,-0.83023715,-0.07273743,0.05804065,0.68319803,0.18857116,0.2292042,-0.29533508,0.06236748,-0.19045539,-0.101078235,0.86024845,0.61423224,-0.27584907,0.33583945,-0.79578185,-0.14933589,0.7151896,-0.5676803,-0.7974161,-0.99583715,-0.410549,0.014136069,-0.25202462,-0.010117175,-0.9940701,-0.09023285,0.006251041,0.96686524,-0.24966976,0.6965645,0.5063621,0.18613648,0.053118944,-0.91374326,-0.14511178,0.92300427,0.9811942,0.18037337,-0.08543539,-0.40426978,-0.24653701,0.21952005,0.5919791,0.6846647,0.309815,-0.2515891,0.398993,0.47303224,-0.45404175,0.6316648,-0.9179262,-0.20656055,0.845199,0.32755113,0.77606,-0.3822734,0.163,0.15671328,-0.9998949,-0.28106803,0.16350505,-0.37628493,-0.54560196,0.72243726,-0.022689186,0.060825124,0.6234167,-0.06804022,-0.5121287,-0.1739009,0.024753476,0.3942694,-0.06258466,0.9541739,-0.5141786,0.41811132,0.05985356,0.3007633,-0.5957226,0.6369423,-0.08391807,0.029430822,0.13052882,0.97057885,0.5165152,0.3956611,0.14118487,-0.8371687,0.2633125,0.34183756,-0.28148407,0.48296726,-0.13171114,-0.08041855,0.23461461,0.0062318,0.21609658,0.99705,0.55816275,0.2843486,0.34781927,-0.28727016,0.14299938,-0.55620855,0.070713304,0.040718555,0.38967347,0.19244058,0.9998823,0.019100374,0.3418261,-0.009924581,0.09861133,-0.26915967,-0.47973043,-0.34835857,0.009504294,-0.16971657,0.39729136,0.9996503,0.06825699,0.97991246,0.31734696,-0.47594452,0.4319901,0.39893213,0.051233847,0.99552035,0.62749654,-0.44420892,-0.8007343,0.58700556,0.6125156,-0.24540573,-0.11035828,-0.21262416,0.99869186,-0.04359763,-0.8533825,-0.98208755,-0.5385593,0.45355144,0.115440086,0.08503598,-0.15146057,-0.64484704,-0.27769965,-0.40435433,0.1301287,-0.29808655,0.023280304,0.094288334,-0.21514125,0.62459195,-0.98743635,-0.46737322,0.17461316,-0.4844058,-0.13648626,-0.1836892,-0.78874296,0.5433508,0.4115742,-0.9666071,-0.022911975,-0.05183945,0.29857785,-0.39086676,0.6920289,-0.6979381,0.630799,0.047984377,0.43360636,-0.09029611,-0.06424264,0.46313116,-0.4306976,-0.032092944,0.4483621,0.056018453,-0.49430102,0.000488184,0.20258282,0.32873714,0.4527781,-0.17536868,-0.49014422,-0.1692354,-0.9010283,-0.010609372,0.14445443,-0.01765431,-0.7341969,0.16528417,-0.33608553,-0.45314696,-0.006063551,0.23755147,-0.020489259,-0.3615809,-0.14546236,-0.50089693,0.030556858,0.9943579,0.36452383,-0.23750503,-0.44259152,0.15961534,-0.40562674,0.43782777,-0.30092135,0.4844188,-0.011658087,0.001955503,-0.10031032,-0.27539495,-0.38593718,-0.04955832,-0.2747763,0.8761147,-0.06698167,-0.036401406,-0.13377649,-0.7359767,-0.48179883,-0.18070568,0.18079998,-0.25241527,0.094190255,0.4276173,-0.9997945,-0.39412802,0.25276902,0.007591891,0.28380314,-0.35413083,-0.087587856,0.34146205,-0.5137878,-0.37523866,0.69579,-0.5222307,-0.6041261,0.25271252,0.54148644,0.4014817,-0.46539283,0.6991728,-0.5155042,-0.5113337,-0.9587087,-0.22241585,-0.16306637,0.381644,0.09261033,0.287681,-0.4939279,-0.07274008,0.7554013,-0.43358663,0.999079,-0.56643766,0.7815761,-0.19629386,0.4050317,-0.09594441,-0.08923864,0.2682195,0.4290255,-0.08193029,0.99907637,-0.20865637,0.13500522,-0.07227563,0.76600844,-0.9940237,-0.98763615,-0.4635132,0.15309854,-0.14100572,-0.31799927,-0.07872456,0.40697387,-0.24408336,-0.8368569,0.99541533,0.30987397,-0.26044565,0.10686987,0.015135375,0.5113108,-0.14533448,0.044839248,0.45851764,0.18768169,0.23555645,-0.53934866,-0.98092365,-0.6286289,-0.3236775,0.47005,0.15736578,-0.8726058,-0.15292433,-0.46253344,0.29729715,-0.98035175,0.23112787,0.25623268,0.5172215,0.30110902,0.46152115,-0.55280435,0.22876222,0.75311816,0.18860513,-0.16392584,0.55451995,-0.030137416,0.5482132,0.4210843,0.0848777,0.7856148,-0.042207517,0.24511214,-0.062051836,0.16634278,0.2886496,0.9516355,-0.9967352,0.14645179,-0.42088607,-0.33053592,0.029472971,0.11057933,-0.054693118,0.99638397,-0.69941235,-0.24137022,-0.13398795,-0.20730986,0.3469055,-0.20023212,-0.29422382,0.2345338,-0.5458684,-0.85286134,-0.53998935,-0.08137724,-0.36603308,-0.70074254,-0.84840685,0.9400937,-0.003574046,1,-0.33002844,0.24197479,0.25376633,-0.31983167,-0.7920657,-0.32598856,0.8311465,0.36084342,0.39620256,-0.57479626,0.19678517,0.06457695,-0.34465903,-0.026778152,-0.38247803,-0.32994705,-0.520176,-0.27948716,-0.37461412,-0.8750938,0.5286004,-0.11248139,-0.5506168,0.49763015,-0.85474604,0.008325379,-0.6012994,-0.4227345,-0.41188395,-0.43761966,-0.45867243,-0.18290487,-0.24104257,0.18338174,0.5729497,-0.43852347,-0.004051802,-0.5016407,0.5485739,-0.30570272,0.99995756,0.52497476,-0.8486885,0.030539481,0.998104,-0.14406957,-0.13354549,-0.99873185,-0.44958732,-0.21889518,-0.61732787,0.34834057,0.1541084,0.31592506,0.4156743,-0.60123223,0.20704931,-0.4257794,-0.07300511,-0.36538076,-0.18455456,-0.091186985,-0.9997298,-1,-0.9886808,0.2109559,-0.1538649,0.40818673,0.40006828,-0.32078326,0.75427574,-0.10944327,0.45545274,-0.22047547,-0.13956557,-0.089002244,-0.15736185,0.22586471,0.19574212,-0.38296786,0.25803325,-0.9864748,-0.99953145,-0.66669416,-0.7474267,0.6396701,0.4019613,0.014247189,-0.9811643,-0.3843415,-0.3656973,-0.37344015,-0.23747188,0.2244881,0.49619755,-0.8903555,0.330174,-0.16966031,0.3737703,-0.27640843,0.107292205,-0.7964145,0.68049896,-0.22087128,0.05631097,0.45635316,-0.3865299,0.5240113,0.26796293,0.42283565,-0.2758221,0.07584524,-0.10029609,-0.82051766,-0.31550863,0.24071589,-0.04198131,-0.8872421,-0.03305266,-0.5819293,0.051725533,-0.015691068,0.13893728,0.99996454,0.6608673,-0.17404759,0.16222227,0.13258153,-0.18778506,0.16609433,0.3281271,-0.2550713,0.21649544,-0.31744623,0.8886899,-0.010331288],
    [157,1,"CC(C)CC(C)(O)C#CC(C)(O)CC(C)C",-0.6153275,-0.66643894,-0.30116916,-0.23203751,0.5485624,0.43303624,-0.5949796,0.3881094,-0.4542557,-0.58764726,-0.6125404,-0.041295364,0.16228223,0.85802394,-0.12006816,-0.8257921,-0.26174,0.008523992,0.19448309,0.01877951,-0.44519028,-0.6220763,0.3140135,-0.37330258,-0.043627553,0.7074557,-0.7074407,0.17475663,0.89628065,0.41093457,-0.1325803,0.6408188,0.93440574,0.45149192,0.11094406,0.8584148,-0.53185886,0.16617818,0.97466964,-0.009721337,-0.88558716,0.14132342,-0.11537667,-0.017727181,0.86061,-0.96433616,0.8261886,-0.27086756,0.7925696,-0.15134493,0.3729687,-0.41067764,-0.48994827,-0.5058065,-0.7941302,-0.39884844,-0.11610404,0.5854518,0.27749357,0.5769037,-0.33953995,0.051269673,0.3910552,0.33003145,-0.04007804,-0.63822407,0.8295655,-0.029268421,-0.12492924,0.43883908,0.15115304,-0.9468551,0.037762463,0.89163834,0.7497759,-0.43702152,0.54156077,0.3335046,-0.65853083,-0.9995034,-0.8252571,0.4352155,-0.13449745,-0.3616195,-0.2854307,-0.50671333,-0.68819404,-0.7939233,-0.093766004,0.5564734,0.7115184,0.32905608,0.7840144,-0.40977526,0.8931572,0.5244569,0.8057209,-0.6388937,0.8615951,-0.03422995,0.37259838,0.60104406,0.46111307,-0.17961347,-0.63384265,0.36705616,-0.49010152,0.55597013,-0.99925894,-0.6972532,0.34815243,-0.33954787,-0.43722826,0.28564033,0.49168736,0.7268779,-0.14167358,-0.3705358,0.99806404,0.1993972,-0.44144213,-0.14579125,-0.25783128,-0.13880326,-0.101396,0.2274481,0.1637993,0.26742852,-0.65533984,0.99965364,0.2465862,-0.19699487,0.029554754,0.251265,0.031668335,-0.8144115,-0.27161068,0.8660745,-0.6311946,-0.39281276,0.9985396,0.61883956,0.9684345,0.544295,-0.37766412,0.56053203,0.44867,-0.24018046,0.5240931,0.21186784,-0.15307707,-0.81199855,0.41270834,0.59568316,-0.312164,-0.3475163,0.14874804,0.9638083,-0.92725474,0.32170072,-0.9552051,-0.73732466,-0.5738036,-0.28585488,0.62624264,-0.64537054,0.63052344,0.63692725,-0.08066333,0.4531055,-0.53341585,-0.40544224,0.10815886,0.25098765,-0.20771423,-0.93744576,-0.46272448,0.40117115,-0.6332972,0.76433945,0.21931826,-0.32658708,-0.16759269,0.2825576,0.51659185,-0.5689052,-0.30743343,-0.36542818,0.23432243,-0.6559278,-0.6784349,-0.24612626,-0.16870186,0.8185451,-0.57363355,0.018134898,0.60563827,0.003045751,-0.34250706,-0.55621725,0.122301005,-0.30095685,-0.07974168,-0.51833034,0.19080047,-0.17555323,0.3069754,0.30159572,-0.21517234,-0.99962735,0.25025544,-0.019553026,0.4149731,-0.48569745,0.3473933,0.12730369,0.24548696,-0.029820299,0.021364555,0.25789866,0.1605789,-0.021351585,-0.20637816,0.11676956,0.99990636,-0.39460486,-0.030250825,-0.4807973,-0.6170292,-0.27654624,0.085373156,0.47488546,0.057827786,-0.7402092,-0.006980388,0.058276698,0.33453664,-0.008466398,-0.6998955,-0.38930964,0.80861825,0.6259646,-0.6217472,-0.4473105,-0.9469217,-0.37234992,-0.43297192,0.072761774,0.10611358,0.5360835,-0.4036809,-0.99982274,0.50474036,0.55592316,-0.19584449,-0.3796167,0.061236635,0.32822052,0.6158271,0.10269159,-0.58196956,0.04199347,-0.26358646,-0.52799785,0.41430205,-0.10117806,0.7480609,0.45199272,-0.35023212,-0.19788072,-0.5799799,0.9878086,-0.38191235,0.28842348,0.01856262,-0.842917,-0.016422264,-0.42194176,0.4893648,-0.8756703,0.6689071,0.9990112,-0.2452819,-0.046909608,-0.44030157,-0.39581504,-0.30087513,-0.040497027,-0.95942533,-0.5154813,0.10726671,0.99592906,-0.05232465,0.6897055,0.36845624,-0.118429594,-0.9957988,-0.98422724,0.696962,-0.3462957,0.15427035,-0.36878765,-0.4167163,-0.5786337,-0.6060913,-0.70253503,0.42928892,-0.020610996,0.20041414,0.16011345,-0.095744565,0.25204042,0.52703255,0.20412117,0.7133027,-0.24323279,0.48098788,0.45492658,0.96604574,-0.15184101,-0.690174,0.022996234,0.7376399,-0.13343208,-0.20939259,0.01126126,0.6699565,-0.72360337,-0.31969216,-0.09519279,-0.2037827,-0.09619835,0.70241094,0.48876965,-0.10020114,0.30415332,-0.16444315,0.19210193,-0.324589,-0.60334724,-0.8427593,-0.274269,0.8802301,-0.62550396,-0.18155047,0.35060802,-0.5713774,0.31045553,0.22536574,0.51980084,-0.97957116,0.5419423,0.32390836,-0.37673837,0.63347435,0.4796783,0.6947723,0.9997913,-0.015521923,-0.356272,-0.19652109,0.718306,-0.6567881,-0.5599541,-0.67924285,-0.20149273,0.354206,0.69864357,0.6671609,-0.12159697,0.27837318,0.20456557,0.4309065,0.43469244,0.25317013,1,0.116033494,-0.71629345,-0.012125363,-0.053013396,-0.52362317,0.25653824,-0.09188808,0.51162714,0.073013924,0.26165298,0.3297372,0.30622748,0.3790974,0.043240648,0.34909737,0.29413298,0.001280779,0.42437613,-0.40750545,-0.9854766,-0.48411414,-0.08737283,0.04064324,0.09473177,-0.7181866,-0.12603742,-0.33182707,-0.54947245,0.26259747,0.39714453,-0.5766413,-0.9226387,-0.59152776,0.1269164,-0.083884,-0.08173666,-0.06648924,-0.19383185,0.049531177,-0.680051,0.88417983,0.4021383,-0.8614164,-0.5291007,0.99943626,-0.68414927,0.5252519,-0.9797981,0.024823373,0.46995097,-0.31183568,0.20630525,-0.045932367,-0.02515607,0.13092539,-0.6913465,0.1759048,-0.39070636,-0.5892851,-0.6189641,0.5253241,0.127375,-0.9999108,-0.99999976,-0.9488574,-0.17450161,0.75574297,-0.10799514,0.65696704,-0.67703104,0.29708982,0.051957816,-0.72852975,0.22157222,0.12686676,-0.34331968,-0.1252517,0.398736,0.13929158,-0.17482217,-0.71960884,-0.731355,-0.99986595,0.30137604,-0.16871473,0.035063673,-0.28268707,-0.24715602,-0.95440626,0.6370835,-0.37761635,-0.19061054,0.82428646,-0.39052194,-0.06281786,-0.93046945,-0.44139412,-0.3607858,0.058419455,0.5260271,0.56762034,-0.65599245,0.32463259,0.005550623,-0.20147765,-0.19255447,-0.67859656,0.22225602,-0.09744297,-0.678208,0.63107455,-0.36253443,-0.22926293,0.33152288,-0.22498928,0.50989133,-0.502972,0.85249686,0.04677969,-0.24133338,0.7191934,0.44606954,0.4256332,0.9999652,-0.2343308,-0.31852943,-0.064226285,0.15916914,-0.17158574,-0.003678022,-0.9843304,0.088353366,-0.15008341,-0.052619725,0.83600277,-0.014598393],
    [158,1,"CC(=O)C1CCC2C3CC=C4CC(=O)CCC4(C)C3CCC12C",0.033175167,-0.094424024,-0.3169867,0.2699799,-0.31460992,0.6022987,0.3597328,-0.112230286,-0.116415575,0.05699238,-0.3276937,0.15570605,-0.23183477,0.36724886,0.020773584,0.19628364,0.101524614,-0.6286659,0.020415608,-0.4444287,0.036127735,-0.3591125,-0.81956106,0.0756185,-0.065454505,0.53083706,-0.39454964,-0.66180795,-0.102700934,-0.2387863,-0.66520584,0.20715335,0.39028308,-0.051358603,-0.3730634,-0.061252426,0.40886694,-0.338917,0.999107,-0.058648,-0.47877946,-0.33461493,-0.119796544,0.07823248,0.27623874,-0.3012241,0.7624226,-0.001007696,0.99441665,-0.63770646,-0.23242302,0.5148681,-0.570851,0.08361449,-0.8252583,0.012401375,0.10213512,-0.051648777,0.42493293,-0.5646088,-0.30013368,0.38465723,0.65251195,0.41303998,0.65352213,-0.4801642,0.46641403,-0.4207809,0.5797894,0.6896828,0.4133946,-0.54380846,-0.5101557,0.88164693,0.17224766,0.87895775,-0.5615894,-0.30397698,0.6515828,-0.99994844,-0.10420324,-0.16132383,-0.7011458,-0.5853244,-0.26558194,-0.88085514,0.40215233,-0.45438525,-0.23752058,0.46061417,-0.40080738,0.7334261,0.14330825,0.5245359,0.9931892,-0.5019615,0.7625893,-0.38131487,0.3034813,-0.58790207,-0.140429,0.44389108,-0.007432908,0.8624292,-0.99723065,0.5407052,-0.14635935,0.3511339,0.9571162,-0.12337027,-0.16814867,0.20061125,0.47549146,-0.50619036,0.17045856,-0.266284,0.12912515,0.40712467,0.9734841,0.31625128,0.108523384,0.038404524,-0.11879649,-0.10332816,0.42087263,-0.35764924,0.34766382,0.09794428,-0.05032255,0.99991745,-0.4561818,0.24350399,0.49409014,0.26771623,-0.3749671,-0.9777054,0.44875827,0.16041254,0.40388694,-0.54103714,-0.9993312,-0.64024764,0.7640696,0.018508539,0.167348,-0.40126705,-0.20869024,0.6749722,-0.97991383,0.54342335,0.09862837,-0.89514226,0.91161007,0.7633612,-0.18810631,-0.42520154,-0.5571145,-0.52155054,-0.41959196,-0.9485839,-0.80306816,0.2918433,-0.07006357,-0.1582116,-0.047904264,0.29317936,0.5633268,-0.2938393,-0.11131304,0.089208476,-0.7209577,-0.10862541,0.024700249,-0.34901667,-0.18121189,-0.9808791,0.8329424,0.2594331,0.33172843,-0.18512411,-0.6124994,-0.8360507,0.25362408,-0.49243006,0.3450372,-0.09721543,-0.08257774,-0.20072702,0.16067041,0.50384074,-0.8327663,0.2651391,-0.40746906,0.00636184,0.23760918,0.10827199,-0.48295853,-0.8450785,0.581714,-0.05662323,0.1734012,0.07418236,-0.033988915,-0.562643,-0.11411844,0.45975384,0.3328234,-0.69180197,0.49621102,-0.9999321,0.51808316,-0.16691683,-0.058536552,-0.58409286,-0.097364426,-0.31301558,0.47617915,0.33361006,-0.13259828,-0.72134537,-0.47590876,0.72409254,-0.863964,-0.2529198,-0.9175579,0.3017231,-0.11485816,0.2444599,-0.3983287,0.091634765,0.3210301,-0.7842829,-0.05192589,-0.52776253,-0.21050237,0.2591476,-0.36892733,-0.44690487,-0.19013023,-0.17591488,0.92240274,0.5302155,0.84024125,-0.27882963,-0.8841352,0.16856566,-0.48266885,-0.03941497,0.083653934,-0.6270615,-0.06411114,-0.38906002,0.3225999,0.6672258,-0.15963824,-0.19641685,0.13335994,-0.014108681,-0.6748313,0.18585378,-0.6040111,-0.044128474,-0.20935199,-0.6310291,0.73415136,0.116123475,0.17146887,-0.4358586,0.96859366,0.474032,0.16441873,0.99808073,0.2726051,-0.5031068,-0.5167756,-0.5017751,-0.275441,-0.8808914,0.4584755,-0.6322986,0.5354802,0.995082,0.12427992,-0.18803634,-0.24389577,-0.004457485,0.29324055,0.9381872,0.36142218,0.26543626,-0.058327846,0.81284463,0.29375845,0.33862412,0.5475813,0.48062184,0.99998903,-0.9962996,0.5727161,-0.34709296,0.2733152,-0.30888933,-0.13620633,-0.6504309,-0.75737095,-0.9903516,-0.96555066,-0.57108676,-0.28186283,0.38824725,0.387244,-0.4172643,-0.33365804,-0.49410772,0.19069657,0.33803278,0.5571986,-0.22562541,-0.99982536,0.120791376,0.44953367,-0.092163816,0.14849336,-0.6565195,-0.24707541,0.12941669,0.17883085,-0.86835337,0.3140543,0.24863753,-0.1777047,-0.61452234,0.6464102,0.03820274,0.20819545,0.78530777,-0.32114637,-0.2415524,0.32349038,0.583976,0.69346666,-0.16600005,0.8064926,-0.27477375,-0.32188872,0.7087628,-0.09417686,-0.20173052,0.40283924,-0.8371596,-0.9076531,0.113063045,-0.17961301,0.1994285,0.21669017,0.17526276,-0.14825392,0.9983947,0.21531028,-0.13557057,0.0785527,-0.1186784,0.44169238,0.58381116,-0.9148434,0.41789013,0.5347759,0.405451,0.4052906,0.45965007,-0.8467358,-0.025860067,0.46441284,0.21516947,0.20549646,-0.99996394,0.23157385,0.10896663,0.26712653,-0.3178174,-0.5784155,-0.231336,-0.04089379,-0.41926733,0.33009493,0.4938397,0.15746857,-0.11702658,-0.17989834,-0.88460237,0.70277697,-0.14547911,-0.29836023,-0.6241029,-0.4786454,0.36689135,0.15369278,-0.24566281,0.5793088,-0.15771042,0.26872858,0.12146227,-0.58009756,-0.56500596,0.31056905,-0.4080833,-0.7192049,-0.5058486,-0.2177424,-0.08313046,0.40908256,-0.46214476,-0.2977933,-0.47090378,-0.016891206,0.035192408,0.9999987,0.73243636,-0.9743363,-0.14689524,0.99680346,-0.13223806,-0.060728684,-0.99991244,0.7341927,-0.42291752,-0.2487047,0.4395019,0.13107899,0.3169107,0.01794782,-0.7865343,-0.22170275,0.123654604,0.7677629,0.44833192,0.5704177,0.09064783,-0.9999131,1,-0.07617039,-0.18541922,-0.1590969,0.75824445,0.39716282,0.30857083,0.8320676,0.15353538,-0.60919476,-0.51356506,-0.16216171,0.18425119,0.58080024,-0.5958562,0.061501056,-0.32318377,-0.32552218,0.6432418,-0.99953794,-0.60417986,-0.22291309,0.54993784,0.22848463,0.26505202,-0.9121613,-0.20173153,-0.16509949,0.27067867,-0.2981081,0.7829968,0.22518846,0.2822342,-0.43231648,0.70156467,0.5327303,-0.2891706,0.15159611,0.32366964,0.36061648,0.06238518,-0.4384426,-0.7869198,-0.98623824,0.44187975,0.24767184,0.38423988,-0.6048699,0.14517128,0.014484795,-0.97731227,0.2939369,-0.39335,-0.09378257,0.99677444,0.6448107,0.07538422,-0.30575344,0.27363393,0.68069816,0.99996084,-0.071403466,-0.2954137,-0.26445395,0.19292672,-0.25596848,-0.26253936,-0.99881977,0.61606354,-0.30462357,0.5316586,0.90783006,0.120478146],
    [159,1,"Cc1ccc(C(C)(C)C)c(O)c1",-0.71942383,-0.6262256,0.049177743,0.2275194,0.08517082,-0.10750208,-0.5919698,0.06673709,0.08837568,-0.2551156,-0.7856065,0.06810409,0.19126102,0.237019,-0.20515545,-0.47975045,-0.32561907,-0.67710614,0.5212547,-0.39788672,0.29032916,-0.74579537,0.36265907,-0.2726853,-0.21758306,0.45881388,0.2817266,0.3210513,0.7006397,-0.24685268,-0.6999307,0.67854,0.00740962,0.26325932,-0.2827155,0.6880768,0.17638133,0.5879735,0.42166558,-0.9351541,-0.9955015,-0.7496631,-0.07865722,0.06018487,0.10327026,-0.99497986,0.12203303,-0.011790575,0.9866508,-0.4428704,0.5149466,-0.005080129,-0.13522048,0.64931655,-0.9664399,0.2712966,-0.5592173,0.8835033,0.24290183,-0.31293464,-0.19028194,-0.60754275,0.41284642,0.007478855,0.14559478,0.5451918,0.24900252,0.6356064,-0.14968248,0.6428393,0.79846394,-0.92581147,0.23622617,0.3390246,0.80953765,-0.28518167,0.567375,0.10494157,0.02028427,-0.99714553,-0.6828149,0.5340258,-0.7197144,-0.037746433,-0.4146643,-0.3822299,0.2579603,-0.40242082,0.04825021,-0.13819487,0.15596545,-0.2724086,0.31012312,0.16247222,0.19534996,-0.19162583,0.32967868,-0.007437176,0.60904264,-0.08050576,0.32630673,0.2888252,-0.10298929,-0.65602595,0.8209737,0.3800946,-0.14903378,0.3556067,-0.915761,-0.05779684,-0.20866992,0.36387774,0.16216551,-0.6419518,0.027078206,0.7523767,0.38642657,-0.041479405,0.9995155,0.17184795,0.10034261,-0.003289274,0.1839773,-0.08066748,-0.105012536,0.53717697,0.38485318,-0.040004484,-0.21466966,0.9998246,-0.5087979,-0.006579922,0.12697428,-0.138925,-0.38386947,-0.54898584,0.47460973,0.5241527,-0.8314068,-0.32025054,-0.9988358,0.40926382,0.9968133,0.46730694,-0.21021523,0.32105777,0.29783055,-0.53543884,0.98980224,-0.19582093,0.15565021,-0.83394355,0.27743444,-0.47130516,0.11036068,0.09769781,-0.20772852,0.9983893,-0.7173618,-0.5819529,-0.9935546,0.15957855,-0.17711006,0.22644399,-0.111258395,0.004449919,0.685995,0.07499171,0.4878799,-0.25816548,-0.75783724,-0.6249748,-0.050498042,-0.6064216,-0.19344328,-0.9819408,-0.7670811,-0.014555276,-0.5897247,-0.36181182,0.331713,0.5496668,-0.4919697,0.315946,-0.79111505,-0.5102065,0.57317036,0.2957238,-0.48906478,-0.7750017,0.8177235,0.5594074,-0.095308624,0.5107043,-0.06844939,-0.1378189,-0.13539104,-0.5156939,-0.04333976,-0.5577769,-0.5213082,-0.36212212,-0.6121217,-0.37259623,-0.026106844,-0.2849516,-0.023330081,0.09413686,-0.30602357,-0.95779943,-0.40673125,0.007008782,0.10724607,-0.26568744,0.5783367,0.16304107,0.2703166,0.25707057,-0.26130685,0.4965475,0.22672126,-0.60740256,-0.45717514,-0.6400299,0.9979191,0.19291751,-0.19008888,-0.30637547,0.24637169,-0.40040722,-0.26390854,-0.23293285,0.6703559,-0.18339856,-0.65204763,-0.4590158,-0.43207338,0.08468723,-0.52312946,-0.073546045,0.8942852,0.36566284,0.2230048,-0.54685307,0.20040356,-0.32049307,-0.036373924,0.27803674,-0.031965706,-0.16194382,-0.39994496,-0.99854934,-0.54850656,0.3462646,0.06667545,-0.554903,0.272986,0.12279368,-0.27435914,-0.10203177,-0.28418872,0.71745795,-0.13073117,-0.53482145,0.5501977,-0.26716405,0.3399263,-0.00513241,-0.44701058,0.64175266,-0.4118465,-0.21583751,0.011487059,-0.2184317,-0.08929679,-0.25450772,-0.115520895,-0.029393505,-0.001279625,-0.6670869,0.5533324,0.9996471,-0.39999035,0.45180187,-0.17555204,-0.001432738,-0.05631232,0.29608712,0.7119971,0.122610554,0.3422707,0.9993733,0.30164295,0.9041227,-0.42692924,-0.53899986,0.99764425,-0.9856662,0.27700165,0.19099769,-0.13618815,0.15098067,-0.30129007,-0.42423958,0.020860054,-0.9096374,0.9937627,-0.12486494,-0.5009972,-0.17240058,-0.29364875,0.25677803,0.069757015,-0.002957108,0.9038385,-0.6302613,-0.3053278,-0.076084286,-0.98834497,-0.30065683,0.23084214,-0.09894072,0.5025124,-0.6096112,-0.32977706,-0.08812234,0.42102242,-0.9506803,-0.2897003,0.44878396,-0.11766922,-0.42004097,0.079088844,-0.53954583,0.11722238,0.6746259,0.07742074,0.1905433,-0.43886948,-0.09651371,0.22208804,-0.13552392,0.6013929,0.3024979,-0.43900558,0.660716,-0.34565797,-0.42702958,-0.065387264,0.89475846,-0.995812,-0.29606655,-0.78211534,0.36047825,-0.08787986,-0.11157445,0.15737566,0.9980767,-0.3065539,-0.55967927,-0.124459796,0.07942457,-0.53358907,-0.47575957,-0.8306232,0.27036065,0.42516252,-0.07915351,-0.25099012,-0.13205136,0.5326578,0.20937276,0.5284214,0.9367982,-0.37320158,1,0.002140199,0.058250878,-0.019965438,-0.082866445,-0.94888246,0.19610791,-0.26425704,-0.70810944,-0.6712138,-0.3061088,-0.1068303,0.34158227,0.2336742,0.7841667,0.37124017,0.27282637,-0.13336667,0.49808204,0.028926592,-0.50602233,-0.1434163,0.118816756,0.89127225,0.112357706,-0.97721297,-0.25808164,0.0755682,-0.3165524,-0.08629131,-0.7529112,-0.53883296,-0.5946021,-0.194714,-0.217632,0.6314815,0.49130127,-0.2256319,0.22438686,0.030426672,-0.17792703,0.9999777,0.5622999,-0.98762035,0.09552854,0.9993906,-0.50046206,-0.22004604,-0.9989995,-0.6309357,0.59087455,0.65419686,0.16779725,-0.57178265,0.2534466,-0.09896683,-0.40467766,-0.3834068,-0.67807704,-0.3208765,-0.030482953,0.004081261,0.14819787,-0.9999779,-0.9994594,-0.9941769,-0.36287642,-0.2182563,0.24267285,0.29980028,-0.6715737,-0.74628526,0.41450065,-0.2621463,-0.23073669,-0.7207209,-0.6914939,0.24759145,-0.4276042,0.52863574,0.40501785,-0.08922712,-0.9792443,-0.999971,-0.4982634,-0.22304873,-0.19164959,0.37623638,-0.13726747,-0.99533075,0.20916581,-0.7502331,-0.063368976,0.1458026,-0.021505948,-0.40756464,0.95707476,0.078028865,0.7387738,-0.1790861,0.78767014,-0.44989768,-0.83554024,0.091864094,0.26315027,-0.48092476,-0.13411772,-0.025892684,-0.41091755,-0.421193,-0.329404,0.23863181,0.07105323,-0.104367174,0.6004757,0.07908348,-0.030699685,0.1424631,-0.74776155,0.215422,0.4783136,0.38923156,0.1192721,0.1275312,0.99948066,0.71491903,-0.000946758,-0.31911796,0.16950157,0.20270108,-0.4925509,0.115567274,-0.5129371,0.15868005,0.4641198,0.74038756,-0.04936638],
    [160,1,"Cc1nn(C)c(Oc2ccccc2)c1C=NOCc1ccc(C(=O)OC(C)(C)C)cc1",0.686112,-0.6158677,-0.13870913,-0.111683905,-0.10889172,-0.41614547,-0.20885657,0.8492408,-0.06642916,-0.4558606,0.2616356,0.24559402,-0.19844398,0.1555137,-0.666645,-0.005422907,-0.49692276,-0.3228905,-0.21844976,-0.05561237,0.6797538,0.55771303,0.7068553,0.7215993,-0.10503471,-0.05549398,0.67693794,0.5275567,-0.83169705,0.9252305,0.24725896,-0.5729218,-0.16115561,-0.1280877,0.3426967,0.29325813,0.000370201,-0.19909808,0.9997215,-0.4565279,-0.87497246,0.29081875,0.7779434,0.5377824,-0.18260565,0.9280482,-0.14766727,0.26981625,0.96980065,-0.18847099,0.4751506,-0.048981585,-0.12678955,0.5116723,0.51757646,0.324877,-0.21947087,-0.8985253,0.1328207,0.150493,-0.17193373,0.42604035,0.4334601,0.27052313,-0.5617385,0.2870251,0.2074765,-0.3059416,-0.61064297,-0.1332127,-0.64515567,-0.59792,-0.40326956,-0.7638504,0.57814133,-0.09182165,-0.29320633,-0.13202047,-0.65819526,-0.9998236,0.7102546,0.18022086,-0.9392738,-0.587442,0.32413793,-0.9726923,-0.30536833,0.11222259,-0.42934248,0.54865867,0.11127601,0.24353033,-0.6011297,0.78037345,0.9991486,0.40139863,0.6088276,-0.2368544,-0.6374122,-0.32148233,-0.27805194,0.48485333,-0.71921474,0.9913621,-0.99967945,-0.95810246,0.2404694,-0.082958475,0.97120094,-0.16861717,0.30088198,-0.71074617,0.29484978,0.40700832,0.56350416,0.21019438,0.034471642,-0.05477709,0.5747627,-0.4859407,0.63858753,0.5231431,0.30617577,-0.2946878,-0.5952689,-0.14306663,0.14431867,0.024078744,-0.64562976,0.9997207,-0.69344497,-0.5150512,0.11705063,0.06913501,-0.35148895,-0.9981752,-0.4199926,-0.6519641,0.37941667,-0.26625365,-0.9999997,0.19273478,-0.12909514,0.20756012,-0.28556174,-0.22352864,-0.3534061,-0.3138822,-0.9991432,0.23447815,0.57810867,-0.535909,0.21984594,-0.28136787,0.39716122,-0.674183,0.02325326,-0.966735,-0.7649702,-0.9473863,0.21679674,-0.75066805,-0.4387835,0.6622878,-0.084831804,-0.6254468,-0.46875677,0.74282056,0.4600837,-0.13551068,0.6659759,-0.57134867,0.6511557,0.44392443,-0.028332986,-0.29051426,-0.4681884,0.59101975,-0.72034895,-0.28072685,0.63688695,-0.9626585,-0.25474188,0.57915217,0.7555915,-0.2593416,0.5125595,-0.21135876,0.6124605,-0.5897428,-0.711542,-0.39077085,-0.412386,0.5258557,-0.27154902,0.53418964,0.51311857,-0.87421817,-0.22232108,0.061757196,0.49875504,-0.6430972,-0.3316171,0.68115383,0.118319005,0.51631725,-0.46178502,-0.90789014,0.15243235,-0.99995506,-0.39334515,-0.09583865,-0.72827727,0.19213489,0.63455164,0.10423587,-0.08186486,-0.4766721,-0.76008165,0.15249628,-0.45490143,-0.3750025,0.42695463,-0.21553826,-0.98814535,0.5452134,0.14202331,-0.15667881,0.40443045,0.7508363,0.43918583,0.7137859,0.426003,0.35777852,0.47544235,-0.628664,-0.11152633,0.70557696,-0.6957422,0.026081586,0.89788896,0.28601435,-0.6556525,-0.45823583,0.46080667,0.1257595,0.258742,0.060212784,-0.40477148,0.4620096,0.15705357,-0.68546987,-0.42792875,0.43314967,0.61545813,-0.001858344,0.25907615,0.6521252,-0.20786804,-0.18806842,-0.024139727,0.7503232,0.43199465,-0.057818625,-0.049194522,0.792875,0.2885977,0.16967979,0.96919286,0.23462471,0.13588043,0.9986503,-0.39335775,-0.15151095,0.49257928,-0.29777277,0.09479448,0.3099994,-0.6277229,-0.5389199,0.22460845,0.93783754,0.24353984,0.25648433,-0.531172,0.60732675,-0.22385995,0.92202485,0.47942233,-0.2801201,0.54401046,-0.5913116,0.88189805,-0.5086419,0.21933335,0.31826946,0.9999997,-0.97195095,0.20671913,-0.5420911,0.13414896,0.15875833,-0.79509014,-0.49666825,0.73234874,0.47377974,-0.9988486,0.2101249,0.9522424,-0.3094838,0.05909344,-0.36037117,0.5658879,-0.27964875,0.07161927,-0.108268306,-0.18453102,0.64669824,-0.99997807,0.2418837,0.19679454,-0.26467365,-0.105170876,-0.82021827,0.41671133,-0.17669672,0.46912828,-0.6567352,0.38012853,0.29555294,0.14111984,0.107582256,-0.48842686,0.44860706,0.4739538,0.67058116,0.115660526,0.11349326,-0.43156916,0.4433307,-0.26292104,-0.3804345,-0.059794176,0.35203075,-0.43501422,-0.12398322,0.61530674,0.08405007,0.47098827,-0.986768,-0.35609788,0.65399224,0.30213845,-0.13227136,0.1824353,0.11687005,0.80439657,0.99953043,0.73558927,-0.5808243,-0.17828047,-0.2760171,-0.26269928,0.5755692,-0.6433562,-0.7542337,-0.7390388,-0.4986564,0.13827153,-0.62677956,0.18396087,0.7792508,-0.23172507,-0.8744235,-0.13090791,-0.9982037,-0.26161316,-0.55185634,0.23762575,-0.66002023,0.35604593,-0.61144185,0.38108933,0.75079376,-0.16338994,-0.753093,0.64215547,0.41041553,-0.1983335,0.3802154,-0.38020524,-0.30036926,0.12090233,-0.1600199,0.06097867,-0.29124224,-0.31854197,-0.031115923,-0.86987084,0.049068674,0.965432,0.72016877,0.7562714,-0.01600016,-0.77711856,-0.43395054,0.37284988,0.34431598,0.5988378,-0.3270368,-0.10575809,-0.6259033,-0.6933413,-0.6946012,0.12861362,0.21781026,0.99999994,0.099442996,-0.9872372,0.09037096,0.99873275,-0.20340472,0.6049977,-0.9999315,-0.121221535,-0.98701775,-0.75562197,-0.15942635,-0.5409649,-0.03397724,0.38930476,-0.17875096,-0.21330877,-0.2512336,0.21597134,-0.2507319,0.11051228,0.020247992,-0.9995353,0.9999999,0.85066754,-0.016216308,-0.002769358,-0.7960499,0.3211342,0.09698038,0.34646913,0.38229465,0.18150884,0.6654236,-0.6986266,-0.5346129,-0.5475728,0.23031649,0.5887788,-0.38980383,-0.30579183,0.9837462,-0.99686337,0.48425967,0.1260872,-0.4925132,-0.36231723,-0.124834694,-0.4291717,0.52999234,0.23796299,-0.114666134,-0.33705398,0.07120687,-0.22539878,0.9884054,0.71646214,0.06342849,-0.35060528,-0.3953911,0.12699859,0.19685698,0.64962953,0.11747368,0.031182192,0.3255331,-0.8904572,0.513428,0.04635934,0.045417603,-0.19558965,0.44817135,-0.13986106,0.51562124,0.057196464,0.8192472,0.06399264,0.99942523,0.6904865,0.4082221,0.2373527,0.42587906,0.29818246,0.99969876,0.58206755,0.05031816,-0.3544256,-0.72255284,0.4725629,-0.12753072,-0.9986511,-0.5522777,0.7104946,-0.22613294,-0.3017745,0.44642845],
    [161,1,"Oc1c(Cl)cc(Cl)cc1Cl",-0.66591525,-0.2019717,-0.059119686,0.57600206,-0.4057718,-0.042239293,-0.2664786,-0.19645068,-0.046518087,-0.279118,-0.8453772,-0.1285997,0.016407283,-0.68965876,0.2613006,-0.5458416,-0.41620958,0.04699518,0.080448255,0.056158695,0.48433265,-0.77421606,0.5056589,0.61021715,0.14287233,0.38771483,0.10631432,0.13016774,0.71389395,-0.46449196,-0.074243955,0.8148846,-0.07330505,0.19512482,-0.26937857,-0.055574734,0.12973017,0.4493373,-0.37497932,-0.95920163,-0.9963046,0.06684442,-0.090984724,0.027238017,0.5474149,-0.99613625,0.26490095,-0.4362916,0.95801324,-0.2237135,0.082946844,0.15113798,-0.051328667,-0.12986541,-0.95780027,-0.1565882,-0.72081006,0.9474131,-0.14466245,0.62068427,0.25163567,0.20918311,0.46938977,0.35014808,0.32053012,0.7195747,0.4758677,0.5567756,-0.25898692,-0.06575499,0.4889141,-0.8871144,0.3871706,-0.26035225,0.76785016,-0.12327293,0.2884662,-0.32207513,-0.1079394,-0.9906521,-0.7439881,-0.4466453,-0.80662996,-0.22006012,0.3485861,0.040797573,0.30303428,0.14557204,-0.40473452,-0.25173086,0.004534511,0.47614017,0.056510013,-0.07024166,0.123441264,0.17543527,0.43646565,0.33225113,0.5295176,-0.5627794,0.7227356,-0.59881055,0.6604166,-0.8540725,0.9718962,0.045905743,0.21181192,0.3837669,-0.89377445,0.519606,-0.48689258,-0.2027206,-0.11297506,0.031470343,0.20154597,0.4565977,0.7283987,0.35695404,0.99916196,-0.3894629,-0.33545214,0.06626482,-0.14659669,0.11485779,-0.39937487,0.113366455,0.2527944,0.019332564,-0.5717898,0.9996996,-0.40399992,-0.5105248,0.72866106,0.07435582,0.3888284,-0.38161317,0.7235691,0.48044652,-0.66104424,-0.16132753,-0.9954085,0.35305363,0.99673665,0.3035927,-0.030205969,-0.3148986,0.41999355,-0.21792033,0.9969288,-0.5822266,-0.13456342,-0.29434234,-0.17379107,0.24405393,-0.43117213,-0.62634647,-0.13297541,0.9993906,-0.6673132,-0.45921814,-0.9891087,-0.5992844,0.30142793,0.17060784,0.70693433,0.49959543,0.17142467,-0.3846829,-0.4080022,0.13588661,-0.8673625,-0.12335382,-0.19223554,-0.30427012,0.39102,-0.9589542,-0.8943384,0.34172842,-0.08159087,0.41300043,0.43335032,0.643799,-0.2421241,-0.04214086,-0.9206561,-0.48196742,0.44456044,0.5093264,-0.3625839,-0.3799584,0.838065,0.25585884,-0.10792015,0.29602918,-0.3385008,-0.21815172,0.6237274,-0.32343942,0.23981996,0.45785666,-0.4861916,0.5506128,-0.8443628,-0.4393097,0.40748632,-0.24734485,0.511469,0.2187175,0.1283474,-0.7184217,-0.11018255,0.23187618,0.189989,-0.106739104,-0.038479373,-0.06577854,0.13725355,-0.34197217,-0.42864048,-0.11494505,-0.20014827,-0.62511164,-0.3442554,0.20166251,0.99188954,-0.44149455,0.32573014,0.77435106,-0.010932138,0.09929933,-0.3617856,-0.4546963,0.42001998,-0.59852064,0.21719205,-0.5472896,0.2522019,0.16356221,-0.5570439,-0.018994978,0.9312448,0.36007303,-0.15402141,-0.68548965,0.68495405,-0.2118186,0.59627557,0.11436041,-0.394502,-0.58183706,-0.26571476,-0.9981748,-0.41489506,0.40308136,-0.36920294,-0.30223697,0.37218484,0.21198924,-0.038032033,-0.062128738,-0.5156918,0.53881514,0.71100974,-0.6712703,0.4865838,-0.19573627,-0.3647138,0.12417194,-0.5143296,0.29282695,0.2892216,-0.672493,0.3900207,0.2994643,0.29834938,0.94224066,0.019486954,-0.09050595,0.14567833,0.11337338,0.4669184,0.9989841,0.099163264,0.8417625,-0.18427908,-0.27246895,-0.50073045,-0.063109495,0.49431777,-0.108056635,-0.48839405,0.99945027,0.07026507,0.78682643,-0.3326959,0.19416519,0.9969884,-0.9684703,0.44931108,0.47832087,0.6936952,0.15886708,-0.11193412,0.35416853,0.13440487,-0.58946747,0.9989487,0.75592095,-0.6988837,-0.3155905,0.30723363,-0.571442,0.35358614,-0.21558133,0.92598224,-0.4345901,-0.006672797,-0.39348397,-0.9505126,-0.064946786,-0.19248816,0.45144767,0.5425749,-0.64819914,-0.50724477,-0.30119964,0.34220535,-0.98285055,0.35388917,0.17895077,-0.3637786,-0.56349736,-0.25720567,-0.041883707,0.08622235,0.6944323,0.092601806,0.29229394,-0.55815244,0.636513,0.01873448,-0.77653044,-0.32177255,0.06800299,0.14308329,0.31004876,-0.13625777,-0.11855336,0.01645938,0.9438942,-0.9959073,-0.29191008,0.03912753,-0.6704402,0.41482195,0.60082185,-0.20888747,0.9898767,-0.14583962,-0.26803473,0.118358776,-0.05670321,0.5399474,0.37254336,-0.87012774,-0.5235856,0.70169735,-0.16555089,-0.18534565,0.006484603,-0.15363052,0.7673698,0.71311605,0.94737947,0.05522723,1,0.4880413,-0.48430222,-0.019656012,-0.2736546,-0.9486508,0.025069153,-0.1480783,-0.63672704,-0.5013949,-0.37071112,-0.36834565,-0.33326623,-0.41112158,0.852284,-0.101766855,0.5375495,-0.5997795,0.1766277,0.21096586,-0.15763034,-0.088812254,0.3606831,0.8875882,-0.3116415,-0.9722437,0.15202183,-0.4635186,0.06340234,-0.08031863,0.075642996,-0.3976043,-0.121981926,-0.5015122,0.06627357,0.73439,0.7191627,0.2678978,0.32762012,0.7558744,0.25179374,0.99984294,-0.17350285,-0.99642026,0.27335307,0.9984686,-0.40595332,-0.31453583,-0.99653655,-0.14905526,0.81291515,0.62165505,-0.31017855,-0.5393245,-0.25831318,0.12779745,-0.22032125,-0.060119506,-0.12889202,-0.39569336,-0.14059286,0.5454532,0.11937606,-0.99994725,-0.99954754,-0.996963,-0.47656327,0.11452274,-0.4123152,0.13880019,-0.80118984,-0.90998423,0.5648026,-0.2359885,-0.023016397,-0.9005248,-0.26549023,-0.1458065,0.06411333,-0.23333202,-0.20283064,-0.40573406,-0.99086505,-0.9998496,-0.1989219,0.089450955,0.16023365,0.43738967,0.35015628,-0.99519855,-0.34620363,-0.4206102,-0.5952911,0.3589161,-0.209651,0.052940696,0.9199176,0.51804787,0.8171374,-0.5801532,0.60424405,-0.2557528,-0.6916094,-0.41701627,0.48405918,-0.66847277,-0.28246635,0.44214883,0.060900427,-0.72051173,0.30771983,-0.07426241,-0.31075755,-0.1045988,0.7753592,-0.26779857,0.25487477,0.004137663,-0.94294554,-0.26587588,-0.095652096,-0.07019409,0.06315827,0.23365328,0.99893093,0.6866936,-0.44021943,0.02297658,0.5810921,0.23247178,0.38234177,0.8704149,-0.20212246,0.70014656,0.62712055,0.65772486,-0.24183632],
    [162,1,"CCOC(=O)NCCOc1ccc(Oc2ccccc2)cc1",0.25959268,0.72787327,0.019877069,0.31802478,0.43668917,-0.6128713,-0.7890831,0.25860107,-0.42622012,0.14740776,-0.09125838,0.33197054,-0.20708041,-0.56478244,0.53878075,0.51326096,0.4674699,0.058948852,0.53604966,0.15804978,0.33250466,-0.62771213,-0.021552242,-0.40656325,-0.42953813,-0.008787793,-0.05679712,0.42614222,-0.3010712,0.28659803,0.25438517,-0.01966096,-0.1983008,-0.7044648,-0.05006695,-0.67224175,0.13186155,0.54521793,0.9928802,-0.8580449,-0.96055824,-0.2081381,-0.078146994,0.03654657,-0.424762,-0.7186256,-0.43561593,0.08223505,0.8998836,-0.107435234,0.7262034,-0.076581575,0.26739895,0.28884932,-0.19716454,0.13523932,0.5946207,0.5039748,0.37923133,-0.19489543,0.174655,-0.14113131,0.42048234,0.31640565,-0.5183505,0.083024465,-0.16234547,0.23400243,-0.3701598,0.53330725,-0.5185233,-0.9470594,0.145612,-0.42125347,0.4404556,0.5145787,-0.10132605,-0.03172822,-0.15090145,-0.99902457,0.15075472,-0.3626788,-0.8906355,-0.17549674,0.41476607,-0.7885922,-0.111768864,0.32868925,-0.5030891,-0.5419352,-0.44061482,-0.37736398,-0.5678678,0.54565126,0.99421513,-0.35383064,0.20169061,-0.25312266,0.1651129,-0.05017852,0.11314915,-0.5505178,0.035497125,0.9908274,-0.94150215,-0.80538106,0.2728625,0.19466186,-0.93446505,0.60413504,0.43627822,0.27663052,0.5197392,0.09992708,-0.5170333,0.4615431,0.07724483,0.85612684,0.99108374,0.6205517,0.39378288,0.57988524,0.39294586,0.041780736,-0.35123205,0.3594905,0.15145786,-0.6009919,-0.02665382,0.999363,0.4141758,0.37154695,-0.2691388,-0.23673303,0.4732863,-0.98035914,-0.22417074,0.46639532,-0.39183426,0.18001033,-0.9997811,-0.16667022,0.8526362,-0.38972265,0.27024668,-0.2459971,-0.6045135,-0.1643104,-0.4579027,-0.13058993,0.63577837,0.02212697,0.5039034,0.21667396,-0.41094464,-0.025903929,0.26247293,0.8821564,-0.17552173,0.59656364,-0.91700494,-0.43747863,-0.29432392,0.5669545,-0.1229073,0.23682494,-0.4996603,0.12825918,-0.23214671,0.114631325,0.31635556,-0.06546184,0.41661537,0.5002049,0.07673904,-0.9530327,-0.5878497,0.3149773,-0.68632746,-0.5852394,0.74152166,-0.80203384,0.28209907,0.22452974,-0.3233892,-0.01746811,0.5352712,0.6300742,0.25292668,0.1607622,-0.43193308,0.1213482,0.11074675,0.43019852,-0.30450377,-0.2651914,-0.042589143,-0.9215841,0.6682824,0.00814072,0.23006546,-0.56342643,-0.056763504,-0.14087258,0.7448517,-0.5396544,-0.035440754,-0.8099966,0.36752164,-0.9997407,-0.11070592,0.15477268,-0.354374,-0.39657018,0.05663081,0.18315388,-0.45914233,-0.0897827,0.2912481,-0.2149797,-0.14036283,0.077267885,-0.32487336,-0.106465206,-0.96485007,0.44378102,0.28467593,-0.050631467,0.4047502,0.33688918,-0.2363506,-0.24140213,-0.18692218,0.23533688,0.34369123,0.27155626,0.04643603,-0.33970612,0.6621922,0.4900896,0.86400884,-0.3573728,-0.3331917,-0.6003846,0.7492043,-0.46709412,0.39146093,0.1531432,0.1753185,0.4443598,0.46733192,-0.96962196,0.14322376,0.3603618,0.40122333,0.5329837,-0.4304859,0.54194176,-0.11428156,-0.15783039,0.22464798,-0.601323,-0.14694498,-0.109342895,0.4062752,0.24745807,-0.2322667,0.7200488,0.09187291,-0.014869372,0.13767496,0.9156105,0.26938337,-0.18963823,-0.39189947,-0.41277573,0.22211286,0.5489698,-0.23019849,0.6231009,-0.15955901,0.99875396,-0.51167417,-0.16154048,-0.68263996,-0.083880186,0.530565,0.12211174,-0.7361713,0.18955591,-0.40424803,0.98541796,0.05500218,-0.1870499,0.19919844,0.52430403,0.999952,-0.9642856,0.38904083,0.5016205,-0.3192841,0.09103876,-0.45730597,-0.15306544,-0.21885861,-0.38337022,-0.5626833,0.1590253,0.9087183,-0.015910348,-0.009263769,0.49720824,0.18886282,-0.41759217,0.33036286,0.083131805,0.3159519,-0.4188799,-0.954802,-0.25354984,-0.24156308,-0.14079347,0.47651696,-0.8729576,0.13280523,-0.1739098,-0.017233383,-0.84627604,0.47165695,0.39094839,0.11334004,-0.31375375,0.07878677,-0.22058283,0.044370685,0.025894945,-0.23733829,0.061426472,-0.042535502,-0.017942369,0.08027773,0.6475669,-0.53522605,0.89606214,0.5661758,-0.54415566,-0.2647723,0.41549337,0.43189728,-0.42116168,-0.9822043,0.24676602,0.045912053,0.15860096,-0.044904575,-0.06490707,0.6262119,0.9998359,0.6366227,0.26673087,-0.204022,0.3161061,0.68719953,-0.21616854,-0.87929934,-0.26350018,-0.15770315,-0.8039723,-0.23813802,0.3341188,0.049516782,-0.084489755,-0.46697456,0.32048818,0.049705587,0.9964239,-0.0315027,-0.16655661,-0.32076946,-0.5043367,0.17044324,-0.55925906,0.7706839,0.060722683,0.42678759,-0.13101584,0.22039148,0.6774879,-0.04146433,0.16553092,-0.14531992,-0.452907,-0.17469881,-0.13549009,0.027051637,0.002965665,0.19364099,0.020794926,-0.8615082,-0.21334092,0.4163419,0.53103137,-0.032499168,0.2876284,0.02621588,-0.22131684,-0.019718755,-0.47351968,0.30049923,0.20081355,-0.66286004,-0.26694435,-0.32473025,-0.116035916,0.16641527,-0.4509956,0.99995035,-0.18078887,-0.94007,0.10948604,0.9997515,-0.32768732,-0.51885927,-0.99887556,-0.21741246,-0.93282276,-0.5090291,0.44958466,-0.38513952,0.29788983,-0.025125764,-0.010390949,0.10709312,0.58457005,0.21249193,-0.1907321,0.5063486,0.12055891,-0.99995255,0.9926624,-0.47912267,0.06873453,0.53545743,-0.45970792,-0.7176946,-0.012075296,0.5626504,-0.02413087,-0.17265154,0.21300168,-0.85846734,-0.4602458,0.6726752,-0.03180647,0.51567847,0.4881553,-0.26867688,-0.108385526,-0.9997809,0.016420372,0.20580256,0.45052695,0.16241704,-0.24808231,-0.9232067,0.30710152,0.3289497,0.015577768,-0.60219306,-0.8012889,0.47785878,0.97081065,-0.5414176,0.5385284,0.6346109,0.096451916,0.11460415,-0.29507855,-0.5147127,-0.4650449,-0.22994974,-0.20341603,-0.31651458,-0.26667106,0.006972411,-0.32360142,0.05340374,-0.6189899,0.50644714,0.5326497,-0.73826724,-0.23981215,0.1368589,0.9763739,0.04088024,-0.5340254,0.0007242,0.011042845,0.54045135,0.9999806,0.63561475,0.24363817,-0.17850693,-0.06506839,-0.6688208,-0.32249126,-0.9781236,0.52859116,0.1713014,-0.36924687,0.25951526,-0.41773388],
    [163,1,"C=CCC1=C(C)C(OC(=O)C2C(C=C(C)C)C2(C)C)CC1=O",0.8604327,-0.47617677,-0.05565223,0.3884703,0.5573889,0.08366553,0.38391674,0.17264527,0.5980961,-0.23875752,-0.111674376,-0.7358954,-0.30395427,0.782021,0.21137291,-0.9082447,-0.1464086,0.2633054,0.42422813,-0.26400074,0.14608386,0.47056645,0.7959157,-0.54097813,0.16711539,-0.028626036,-0.31203824,0.08127237,0.03623796,0.34384194,-0.16974175,0.099243365,0.16605513,0.11149264,0.5211171,0.59869987,-0.64033884,0.23749836,0.99929434,0.1245819,-0.73109967,0.3318106,-0.100521185,-0.61530805,-0.05119681,-0.31693116,0.39066482,-0.20931499,0.99613035,0.4252681,0.10288563,0.58955103,-0.11561586,-0.064417765,-0.3851519,0.16888466,-0.060856223,-0.62840194,0.53368175,0.32989192,0.41384664,-0.25383693,0.15169485,-0.23821336,0.35755065,0.39592806,0.43421417,-0.6959346,-0.13406172,-0.086177066,0.16778669,-0.7656029,-0.44696656,0.8362124,0.577464,-0.22008494,0.5842775,0.2605389,-0.122393936,-0.99977386,-0.131418,0.021041771,-0.80568033,0.626704,0.1822576,-0.7992529,-0.2990121,-0.6001629,0.6654868,0.61610353,-0.3956294,0.36248842,0.2138614,-0.40716404,0.9951074,0.27582973,0.55464524,-0.030636234,0.04914632,-0.046718303,-0.037661552,0.6756361,0.2962582,0.7095798,-0.99697745,0.24468254,-0.58959335,0.5711405,0.95990604,-0.6353083,0.4191421,0.42106256,0.59858406,-0.5804811,0.53439355,0.3449075,0.3244257,-0.094508454,0.97809964,-0.32476905,-0.01232336,0.23147865,0.58696234,-0.6272099,-0.46258798,0.21248937,0.34733507,0.25446945,0.5180562,0.99962723,-0.07975094,-0.2397731,0.28464735,0.101550855,0.44023585,-0.9944989,-0.27403533,0.5321906,0.034219027,-0.64686507,-0.9999716,0.30403882,0.7723873,0.20870593,0.3832584,-0.46471575,0.06290922,0.53381443,-0.957763,-0.16035154,0.30062225,-0.87231284,0.73390466,-0.362269,0.40751368,0.36926228,-0.5099814,-0.24517982,-0.847122,-0.9040766,-0.6477166,0.70801544,0.61459714,0.22217545,0.70170414,-0.39048234,-0.51744956,-0.23888233,0.11416929,-0.23820291,-0.3236087,0.079584956,-0.3941562,-0.591761,-0.27888533,-0.8734372,0.58009887,-0.047551226,0.6698135,-0.04091972,0.10003458,-0.8842858,-0.2221754,-0.014480433,0.67304546,-0.583124,0.26351485,0.6449774,0.12982124,-0.16320284,-0.7698837,-0.1360641,0.20079431,-0.05909254,0.20726418,-0.6073353,0.5239596,-0.9142146,-0.22499204,-0.08953835,0.34256786,-0.518951,0.55147475,0.46661073,0.015650017,-0.48360202,-0.013059358,-0.10139468,0.30600655,-0.99993974,-0.35727942,-0.15445282,0.8776463,-0.76511925,0.51244193,0.52999735,0.7397344,-0.7257137,0.018789291,-0.43209106,0.45029625,-0.43448722,-0.23773119,-0.28771695,-0.98925614,0.7983174,-0.18727872,0.27337995,0.15522152,0.11741107,0.5322194,0.16126369,0.57390636,0.2792247,-0.12710339,0.25786957,0.22842051,0.8166828,-0.09401768,-0.61667466,0.85256046,0.51723665,-0.12998328,-0.2288145,-0.69832325,-0.09704038,0.07123409,-0.19196576,0.4149638,-0.28170148,0.59368366,-0.9709425,-0.074267454,0.07565898,0.22181268,0.098659806,0.25800207,0.109728634,-0.28452885,0.70420396,0.45987192,0.6266592,-0.43941942,-0.27259862,0.38933963,-0.41336805,-0.4262332,-0.20382617,0.9614949,0.37670937,-0.28935328,0.9989795,0.46608242,-0.4896321,-0.10596553,-0.75141525,-0.8360509,-0.67520344,0.21289884,-0.705032,-0.002734935,0.99510944,-0.031696502,-0.46713626,0.05899934,-0.6357479,0.056680325,0.9002061,0.8964776,0.7841776,-0.5439208,0.863867,-0.05979614,0.6887344,-0.2064416,-0.47349522,0.99998873,-0.9853494,-0.37907588,-0.18188329,-0.18721107,0.025603175,-0.26225683,-0.013775384,-0.41041267,-0.871815,-0.95771253,-0.6010136,0.46739385,-0.6660843,0.16081415,-0.302016,0.021898646,-0.7404573,0.24136488,-0.70500493,-0.13517891,0.84820896,-0.9997591,0.6200723,-0.54513603,0.4443579,-0.21764402,-0.20847842,0.2541064,0.63150585,-0.6130605,-0.8337338,0.6850192,-0.80838567,-0.027394345,-0.5484854,-0.3857299,0.66900724,-0.48012266,0.5265826,0.24429135,-0.3108573,-0.090346016,0.0734274,0.64615756,-0.23978978,0.72895813,0.03529634,0.54862505,0.008907782,-0.46631286,0.23448168,-0.028155278,-0.8273188,-0.88326985,0.5965568,-0.290854,0.2541725,0.024138726,0.53657216,-0.6568069,0.9998139,0.66667855,-0.1075719,-0.671835,-0.06383623,0.40421093,0.6128254,-0.6949203,0.33262315,0.43060458,0.81749696,0.6159518,-0.41191033,-0.66851836,-0.4608232,-0.33265504,-0.27200317,-0.3612763,0.9784963,-0.32627198,0.26057774,0.088599175,-0.24497356,-0.6172075,-0.5503603,-0.4367673,-0.23113097,-0.42478377,-0.03672504,-0.42321423,0.3765283,0.5523122,-0.8200647,-0.12669814,0.003693072,-0.44967318,-0.7308249,0.1404887,-0.8329994,0.19253176,-0.53960425,-0.02960384,0.18811393,0.61465377,0.23769398,0.260428,0.7004172,0.35364065,0.5377969,-0.1659701,-0.45528823,-0.10478672,-0.34475312,0.19067428,0.22717015,0.61813104,-0.4978078,-0.32060656,0.6089759,0.9999987,0.5476299,-0.89429235,-0.2898253,0.999579,0.5096173,0.34434518,-0.99994415,0.4906104,-0.78429985,-0.33683446,-0.5423155,-0.3992486,-0.35367495,0.50808334,-0.84015447,0.04449994,0.5238076,0.21081883,-0.25119087,0.1542126,0.21073157,-0.9999357,0.99860686,-0.2247221,-0.09542374,0.21695153,0.529886,0.41767272,0.017794859,-0.51220596,-0.14407498,0.59299743,0.61263114,-0.005753136,0.000683676,-0.7251901,0.18276343,0.5041444,0.27649552,-0.16453966,0.68150795,-0.99967074,-0.5033481,-0.1979927,0.08931235,0.54652196,0.36178893,-0.8215347,0.12463216,0.46189642,0.3154018,0.5512392,-0.1767457,-0.2691073,0.33889022,0.21296942,-0.1819058,0.13139568,0.08482382,0.029701777,0.66426164,0.28840688,-0.17375474,0.20905763,-0.46882823,-0.9460862,0.5381676,0.46102062,0.3373519,-0.16374066,0.07064583,0.052150253,-0.5513638,0.28596157,-0.56319386,-0.56247866,0.9946223,0.24339353,0.3686155,-0.52456754,0.42203587,0.058348294,0.99995095,0.3064289,-0.531857,-0.39381793,-0.054301508,0.22230588,-0.21331297,-0.9991141,-0.061844453,0.72196585,0.42646635,0.76598173,-0.44266888],
    [164,1,"CCCCCCCc1ccc(O)cc1",-0.6823535,0.14273596,0.19294846,0.42074737,0.3685362,-0.11841009,-0.54369086,-0.07101642,0.13864174,-0.19880693,-0.8119445,-0.28327975,-0.040437736,-0.8915316,0.62442917,0.52265567,0.61330444,-0.2545311,0.39429334,-0.38784286,0.29730895,-0.8598099,0.11164471,0.5509173,-0.39162585,0.09195162,0.4017299,-0.13443281,0.61357933,-0.4531343,0.11847031,0.5395036,0.49312133,0.014245618,0.032587018,-0.55457217,0.10225107,0.6241853,0.25876617,-0.9504251,-0.99180573,0.06343347,0.16761026,-0.14224401,0.27706435,-0.99166596,0.15246014,-0.22402035,0.96371204,-0.027980855,0.70338166,0.004650123,0.29304826,0.21596462,-0.9208697,-0.13599846,0.802219,0.9753752,0.5446702,-0.16294797,-0.32330287,-0.39899102,0.11145877,-0.030461451,0.17076458,0.17184633,-0.4121784,0.43346894,0.39364573,0.09733275,0.82753533,-0.7199489,-0.037029993,0.22644638,0.87764025,0.46915624,0.02936959,0.06676494,-0.14530505,-0.99816257,-0.78802025,0.123360604,-0.888953,-0.39472586,0.08430808,-0.77158004,-0.07731491,0.27299717,0.08503552,-0.7909104,-0.39285955,-0.14174494,0.3285224,-0.01239901,0.26492935,-0.3755913,0.7827242,0.10753847,0.34286186,-0.2461387,0.22921886,-0.13432746,0.48744854,0.80994767,0.8438856,0.6033328,0.4201816,0.20067516,-0.9372379,0.3082226,0.40533656,-0.13731875,0.6058131,0.050823458,-0.2120412,0.5059885,0.20309903,0.18034294,0.9976102,0.56279516,0.2501835,-2.7e-05,0.025248084,-0.10640074,-0.5393274,0.4082638,-0.041855272,0.036433518,-0.020193757,0.99996555,0.01914052,0.35757285,-0.33247277,0.080181934,-0.52910805,-0.38779172,0.17365807,0.7754053,-0.5537743,0.007652935,-0.996106,0.00921234,0.9958895,0.04583045,-0.23197405,-0.06857972,0.20158122,-0.38604113,0.9837184,0.41608948,-0.15653872,-0.8216034,0.76221436,0.40254962,0.018889684,0.20542833,0.2292868,0.9973174,-0.14447124,-0.5196404,-0.9880181,-0.036675222,0.2786796,0.52890104,0.41752878,-0.06574224,-0.0724775,-0.36300898,-0.43740076,-0.4842102,-0.061677735,-0.092489526,0.30550942,-0.1026001,0.09063881,-0.9870634,-0.54010636,0.56656086,-0.6944755,-0.3917951,-0.024393808,0.6394918,0.5148355,0.639234,-0.9108118,-0.023023328,-0.16245873,0.43292382,-0.45285875,0.32117823,-0.308437,0.22709055,0.42070055,0.544269,0.050767068,-0.17980812,0.23953995,-0.37519756,0.6521052,0.14344846,-0.30393168,-0.43594024,-0.011134283,0.5122403,0.33820695,-0.43475875,-0.08827375,-0.74783427,-0.15105683,-0.9700511,-0.3697531,0.1817338,-0.05891909,-0.6525835,0.26946712,0.013572576,-0.26698446,0.3915722,0.3161684,0.116460584,-0.3287609,-0.015236726,-0.4572811,-0.48683122,0.9988403,0.5421556,0.27382794,0.35752878,-0.37556702,-0.3375829,-0.12100077,-0.33428767,0.5539663,0.37675947,-0.2165702,0.048656445,-0.016797272,-0.49151078,0.4266558,0.25326705,0.9007159,-0.32527387,-0.30070725,-0.44147813,-0.13312466,0.3894058,0.20149188,0.26422372,-0.21744445,-0.08605468,-0.10503285,-0.9978389,-0.2754137,0.70929,0.01726162,0.15359977,-0.24003166,-0.35043675,0.5850609,-0.2571372,-0.6246498,0.3141897,-0.6290797,-0.6871928,0.55499613,0.38216367,0.68472207,-0.44935095,-0.6973401,-0.015764434,-0.27142504,-0.40655282,-0.1584989,-0.15389688,-0.47707283,-0.31639308,-0.06062493,-0.26397356,-0.32739088,0.67093027,-0.15657893,0.9993959,-0.21957976,0.6762882,0.16518518,0.11653213,0.04460802,0.30952975,0.8440728,0.5038319,-0.24907306,0.9990309,-0.24514194,0.24724604,-0.25616306,0.70083123,0.99713427,-0.9968026,-0.003053741,0.1921144,-0.16933881,-0.31145942,-0.05579017,0.35886997,-0.019766469,-0.933478,0.9811799,0.59319735,0.1987966,0.16297814,0.46470127,0.12507318,-0.039459217,-0.26013792,0.94001144,0.06322425,-0.13285038,-0.17471375,-0.9492721,-0.47785997,-0.2990091,0.10371687,0.1646026,-0.84290016,-0.4970475,-0.62306863,0.5104564,-0.970538,0.52789515,0.44734228,0.18126856,-0.25764474,0.3032893,-0.3014821,-0.07611624,0.8835606,0.12503006,0.26738957,0.7369915,-0.1853767,-0.35503006,0.3600381,0.38905263,0.76683795,0.28300032,0.11004304,-0.4379473,-0.37302098,-0.07355735,0.89216626,-0.9965753,0.041799966,-0.7221659,-0.27983773,-0.14848979,0.040460613,0.67966306,0.999111,-0.24805227,-0.16426694,-0.15732735,0.30433705,0.3828038,0.10364377,-0.7992178,0.28818086,-0.5691451,-0.75604105,-0.43491307,0.19982465,0.16382083,-0.2811917,-0.7156768,0.92272216,0.30191,1,-0.13326778,0.24664092,-0.32301283,-0.085646436,-0.69471145,-0.32466593,0.75033873,-0.6658615,0.32866868,-0.53445405,0.2459912,0.4434984,0.047072794,0.411327,-0.19605075,-0.010843085,-0.33325928,-0.4220047,-0.1376576,-0.6280241,0.28665233,-0.5569515,-0.5252463,-0.28072912,-0.96494126,-0.14800565,-0.52614397,0.10199378,-0.03073817,-0.28996953,-0.49139768,-0.6728813,-0.29342726,0.51536226,0.5904232,-0.2188669,-0.28488275,-0.298532,0.20551477,-0.62096626,0.9998807,0.38948435,-0.97190493,-0.15889685,0.9990179,-0.6369754,-0.45486155,-0.9982268,-0.054918524,-0.23408097,-0.37152582,0.12413117,-0.061244294,0.661493,0.14621541,-0.79650295,-0.07532107,-0.16856316,-0.31906515,0.1392365,0.003337815,-0.15589732,-0.9998734,-0.99882716,-0.965135,0.5514521,0.001829698,0.122261435,-0.37057373,-0.59335697,0.69490695,-0.11745594,-0.05176391,-0.16307808,-0.67864656,-0.5555233,-0.14949271,-0.41964233,0.22913533,0.28094304,0.078210644,-0.9625122,-0.9997944,-0.49795088,-0.6558734,0.31437752,0.54195845,-0.20388138,-0.997598,-0.2112182,-0.6574073,-0.4506398,-0.38482305,0.03799073,0.3267037,0.9158252,-0.15337208,-0.08472555,0.6020365,0.64661837,0.32120124,-0.86461073,0.24004214,-0.400908,-0.46327034,-0.27182272,-0.37744278,0.40018395,0.19339882,-0.30405536,0.01967904,-0.6644803,0.2764937,-0.32769853,-0.6161809,-0.21416682,0.12671404,-0.52107173,-0.013302508,-0.36666235,0.032394964,-0.15562823,0.2814432,0.99992174,0.69077855,0.44803035,0.39440376,0.6756012,-0.25527096,-0.011780055,-0.121697895,0.013346922,0.50970554,-0.37770006,0.6018537,-0.24682288],
    [165,1,"CC(COc1ccc(Oc2ccccc2)cc1)Oc1ccccn1",-0.20624797,0.15258726,-0.092008665,0.25874138,0.016492262,-0.48134658,-0.60797125,0.38084882,-0.23649433,0.1892826,-0.46896708,0.14471601,-0.5053191,-0.6511475,-0.14022958,0.49602628,-0.18217741,-0.07131709,0.5418319,0.102131106,0.2939618,-0.45749852,0.11874069,-0.22371726,0.003864261,-0.32387447,-0.28161812,-0.03785557,0.022624675,0.32463196,-0.052626275,-0.457763,-0.21630244,0.26432133,0.19663213,-0.073551,0.15775742,0.4902829,0.9973724,-0.92409956,-0.8696597,-0.35995024,-0.1420688,0.33718428,-0.20033877,-0.45243853,0.036735553,0.3235267,0.93029046,-0.6704278,0.8112353,-0.09177016,-0.65273184,0.15786168,-0.18685833,0.34329745,-0.25015977,0.33152312,0.26755092,-0.34791744,-0.2675405,-0.60084754,0.36477184,-0.114928104,-0.45447204,0.21147522,-0.17054352,0.3553208,-0.24140725,0.37639147,0.2991347,-0.5973214,-0.011316477,-0.5961336,0.38474616,-0.55536956,-0.5966936,-0.14083199,-0.63014615,-0.99811924,0.6086487,-0.13413383,-0.8363389,-0.05302721,0.12379624,-0.9649569,-0.7605655,-0.22357154,-0.32047063,-0.19843072,0.008534935,0.47563156,-0.10116276,0.5355403,0.98724276,-0.16257006,0.74623567,-0.13123979,-0.09790753,-0.41764683,0.40866446,-0.16295806,0.000956029,0.9981947,-0.9841203,-0.8420737,0.5246379,0.5497512,0.9592174,0.42272294,0.35847455,-0.32688552,0.4871337,0.62242156,-0.3921575,0.57735664,-0.3646986,0.62420505,0.97858304,0.48647416,0.33454794,-0.1619571,-0.052025974,0.25775298,-0.48503464,-0.38479346,-0.2785301,-0.8218385,-0.19061558,0.99975336,-0.04200741,-0.33972958,0.5140517,-0.3106953,0.44603294,-0.988807,-0.5474161,0.40528676,-0.24448435,-0.10108609,-0.99998546,0.25381348,0.91002697,-0.7026086,-0.16313651,0.7035459,-0.304933,-0.21684386,-0.8036988,0.21109186,0.573748,-0.46391484,0.32253054,-0.24957609,0.2892478,0.3553478,0.013250502,0.42076445,-0.38056844,-0.94080615,-0.77529716,-0.02306314,-0.1357459,0.6871746,0.29306775,-0.054399252,-0.24694811,0.49393755,-0.22408265,-0.112218976,0.54663426,0.009388642,0.37470838,0.35230368,-0.030780438,-0.9221729,-0.6386751,-0.25899953,-0.7935991,-0.4442599,0.6049628,-0.017673455,-0.32699236,0.47329482,-0.18414745,0.0411654,0.63079005,-0.2006441,-0.25250387,0.31649014,-0.6486044,0.08821131,-0.46479332,0.33547384,0.1577979,0.04295944,-0.57428724,-0.6786481,0.47159916,-0.009062367,0.4702341,-0.59610116,-0.13298796,0.64707464,0.33665583,-0.40064746,0.3656307,-0.85706896,0.363191,-0.99983746,-0.6487523,0.42467886,0.079240546,-0.15933348,0.18684502,0.22866116,-0.7430444,0.39702517,-0.2639788,-0.19115941,0.30504423,0.2914142,0.21228257,-0.3675236,-0.9463095,-0.03610482,0.08919725,-0.3440053,0.24829254,0.52768016,-0.14835814,0.108454965,0.409444,-0.33201998,0.7974944,-0.17117338,-0.22027771,0.35977688,0.07669544,0.41018024,0.90239817,0.33386803,-0.23682672,-0.56475925,0.78962773,0.27921566,0.7952889,0.41341045,0.36565855,0.5216196,0.14572568,-0.724528,0.1565603,0.6325347,0.41732383,0.5291012,-0.646564,0.6448045,0.15926541,0.1751257,0.5102335,0.06780006,0.05570248,-0.5492927,0.3249839,0.19727813,-0.59298223,0.08907668,0.67373925,-0.08203557,0.006976827,0.9787115,0.33986732,-0.09670513,-0.13500568,0.44236216,0.19494477,-0.0827886,-0.24507613,0.5547248,0.16649736,0.99792385,0.049659103,0.5310257,-0.5978264,0.6425777,0.67056185,0.89810467,0.86811674,-0.16383412,0.14179634,0.955994,0.032571163,-0.84429055,0.013264095,0.024477856,0.9999971,-0.99337846,0.2511638,0.3681521,-0.4340126,0.26359794,-0.4998861,-0.25901592,0.3957752,-0.6949629,-0.9192071,-0.19693345,0.95722234,-0.12884174,-0.097805314,0.13598809,0.34905568,-0.16490285,0.8931921,-0.1531672,0.14482807,-0.4282449,-0.999848,-0.09859506,-0.28305024,-0.15493706,-0.055604223,-0.77445734,-0.042170558,0.037070457,0.1683124,-0.6794355,0.10029651,-0.14989987,0.71622044,-0.09816633,0.3229089,0.028936842,0.014273512,0.8169713,-0.07528178,0.09666045,-0.24704236,-0.29210743,-0.49378872,0.56980795,-0.1966698,0.64279693,0.22117238,0.38082707,0.081590585,0.6378776,-0.32188588,-0.6510491,-0.965321,0.7159738,-0.12679285,0.21419342,-0.47374868,0.14395365,0.6526874,0.99971575,0.29498404,-0.2456826,-0.60471624,0.17037866,0.22266552,-0.49376997,-0.8547966,-0.099924624,-0.3929263,-0.7512479,0.46995407,0.053607643,-0.36413702,0.056922875,-0.5301175,0.017064292,-0.073317304,-0.992243,-0.086466886,0.11754083,-0.4727356,-0.6273052,0.050733216,-0.55074245,0.6930381,-0.6310307,-0.1914622,-0.29402876,0.5085635,0.25507212,-0.03297675,0.11375043,-0.18487008,0.08371667,-0.12566763,0.056575168,0.5235826,0.24261974,-0.269635,0.3101248,-0.82803315,-0.47390467,-0.013808406,-0.22324254,0.050522946,0.42196852,-0.77099544,-0.7180368,-0.100739524,-0.5958657,0.10534881,0.3539776,-0.4741763,0.3037082,-0.56690645,-0.42312077,0.17358196,-0.1328179,0.99999964,-0.12666129,-0.96679264,-0.1725396,0.99768245,-0.39653078,0.19913359,-0.9999343,0.65786326,-0.96339756,-0.49447188,0.6917442,0.13049743,0.42668518,-0.8516835,-0.17630105,-0.25143665,0.49159288,0.17556636,-0.026223991,0.39573482,-0.39462727,-0.999945,0.99999905,-0.020274004,-0.3309118,-0.36925113,0.32950956,-0.5162468,0.11607613,0.7207193,-0.04116078,-0.09038522,0.42092985,-0.8259466,-0.35561237,0.12182904,-0.32368767,-0.1517707,0.5677419,-0.85196555,0.51900846,-0.9996657,0.046424784,-0.04832911,0.43088192,-0.19854179,-0.27319506,-0.9789469,0.64950013,0.03426314,-0.30009845,-0.19426516,-0.789566,0.06301882,0.984914,-0.38942772,0.33267015,-0.30842495,0.5760177,0.25556624,-0.3633613,-0.15100457,-0.69736636,0.49898958,-0.5111615,-0.7893018,0.15140417,0.008464641,0.01109877,0.089485385,-0.55504566,0.52298766,0.5765349,-0.6418203,-0.18694891,-0.24579869,0.99321973,-0.54565305,-0.06762538,0.17951728,0.21913414,-0.26466614,0.999978,0.782828,-0.044042874,-0.3385022,-0.13755883,-0.2698981,-0.36216003,-0.9887848,0.22818725,0.48283088,-0.69277114,-0.37057173,0.07584794],
    [166,1,"CCCN(CCC)c1c([N+](=O)[O-])cc(S(N)(=O)=O)cc1[N+](=O)[O-]",-0.11325232,0.3021385,0.45487043,-0.579593,-0.2581208,-0.22264299,-0.68807507,-0.25094822,0.53404045,0.5805944,-0.35752508,-0.2693037,-0.2177079,0.4316818,-0.16536225,0.07141481,0.12099236,-0.26271433,-0.68260926,0.075263344,0.7887156,0.6969814,0.1786619,0.66919845,-0.15922931,-0.18919843,-0.257723,0.14575657,-0.65280855,-0.6632241,0.25127766,-0.014835601,-0.79630774,0.29634345,-0.58288187,-0.8784866,-0.6594378,0.59567493,0.99932176,0.6588955,-0.9605923,0.3160236,0.29708096,-0.10357154,-0.14491029,-0.44738123,0.50073737,0.59983516,0.77354443,-0.044884242,-0.012986689,-0.41404498,-0.51796174,-0.047076844,-0.11592219,-0.21697274,-0.002439979,-0.8320702,-0.045242235,0.19737948,0.20456481,0.8357218,-0.57463795,-0.1545749,0.43922433,0.9237608,0.43387064,0.191894,-0.12120792,0.032696176,-0.7627123,-0.9957218,0.5774607,-0.5678043,-0.7588187,-0.124574676,-0.10524283,-0.67746335,0.12390206,-0.9998014,0.7415482,-0.66018915,-0.85524756,-0.8197291,-0.1484133,0.20747699,0.044602368,0.3074076,-0.8654609,0.673727,-0.39810163,-0.51273495,-0.35385686,-0.36749423,0.999982,-0.044592608,-0.6341882,-0.49205765,0.1585208,-0.29956728,0.17798941,-0.10089337,0.59223074,-0.75765747,-0.991719,-0.8767405,-0.18526016,-0.54797065,-0.858975,0.45171943,0.81847745,0.06925788,-0.70783895,-0.5248699,0.4250324,-0.4183345,-0.61217284,-0.3540137,0.9956603,-0.628062,0.33643848,0.38183802,-0.05595944,-0.26698074,-0.62792194,0.050382115,-0.44310132,0.26277685,0.42902812,0.98779064,-0.041364975,0.5536514,-0.28090987,0.66577345,-0.10589903,-0.8822885,0.6617461,0.2265454,-0.90198326,-0.55881,-0.9951431,0.055494938,-0.8100161,-0.48368654,-0.11748196,-0.6309391,-0.34525827,0.39255825,-0.8382356,-0.3255436,-0.49433568,-0.23456226,-0.8326338,-0.55372804,-0.3216756,-0.01958622,0.14896835,-0.2958585,-0.9071191,-0.46597177,-0.82459354,-0.39644027,0.56154966,0.6534476,0.5775397,0.8060527,-0.74925,0.34541807,-0.35585576,0.3627412,0.1591073,0.5075215,-0.027283577,-0.5498885,0.7889605,-0.63980657,-0.7631475,-0.11199335,-0.13433763,0.38602558,0.37313637,-0.9999898,-0.7153792,-0.5901411,0.8703046,0.8057449,0.20912728,-0.22755663,-0.84827316,-0.6274349,0.5458229,0.6629632,-0.17217343,-0.26635206,-0.24978757,0.041305352,0.537711,0.9459228,-0.42788962,0.82863885,-0.3757323,0.76309305,0.72076577,-0.2320688,-0.7337883,-0.59306175,-0.242593,0.25060144,0.112673976,-0.9995194,0.5653341,-0.2909442,-0.20662588,0.0494835,0.15326819,0.65544504,0.51902676,-0.4336975,0.23882021,-0.88071483,0.054462805,-0.88083816,-0.1807522,0.61017174,0.97374684,-0.29204157,0.69091105,0.77349186,0.42064252,-0.51257986,0.61659974,0.7455839,-0.47913197,0.32593834,-0.787211,-0.008012275,0.014132711,-0.7872288,-0.3587043,-0.12708631,0.22782016,0.19221085,0.6109318,0.4575129,-0.3875988,0.51467794,-0.6859333,-0.15566932,0.02450183,-0.117641814,-0.3484167,-0.9981864,-0.30968705,0.41948044,-0.1940954,-0.37069798,0.001480705,-0.58035034,-0.15707746,-0.49045953,-0.79806167,-0.14935692,-0.75924927,0.5409639,0.79325986,0.03692229,0.6745034,0.27541572,0.7613714,0.22403245,0.7626359,0.8876719,0.34068048,0.05534811,0.3018292,-0.4407665,-0.17049177,-0.101705566,-0.89622575,0.23687908,-0.005159546,0.98931956,-0.5367902,-0.69367146,0.2491695,0.3313999,-0.17466418,0.17305909,-0.76526695,-0.22134678,0.70172036,0.84137255,-0.41745052,0.9832795,0.067815155,-0.43822977,0.99881226,-0.6964973,-0.78631365,-0.5849705,0.21131772,0.92253065,-0.91711843,0.007186564,-0.50116783,-0.26505867,-0.9049844,-0.019819615,-0.47308007,0.1350084,0.5594595,0.6149319,-0.23606844,-0.5441405,-0.9989241,0.85131997,0.77722526,-0.2838166,-0.9695552,0.25508296,0.006349705,-0.09362698,0.24577148,-0.79742575,0.103036895,-0.7902812,0.1832236,-0.73888785,-0.15776019,0.048058555,0.77340966,-0.22842349,0.19379687,-0.5849719,-0.73967874,-0.8966294,-0.38916397,0.30137053,0.112823606,0.6869724,-0.361502,0.7011076,-0.4832412,-0.010312817,0.30569804,-0.4408118,0.49589622,-0.1559194,0.46204165,-0.8401645,-0.7238391,0.50292504,-0.13163587,-0.017816646,-0.47521377,0.59402716,0.2543331,0.9996989,0.52910316,0.41093937,0.26100296,-0.56735325,-0.5320833,-0.07772715,-0.012015563,0.1688585,-0.028514856,0.24246493,-0.40695685,0.07510621,-0.6733999,-0.28209612,0.6655724,-0.20128289,-0.23933288,1,-0.12938198,-0.31006613,-0.3037369,0.69605047,0.104593135,-0.34039244,-0.7142856,-0.74132746,0.8666783,-0.12801495,-0.4178386,-0.77136993,-0.3743696,0.61747235,0.16297072,-0.9065472,0.15573019,-0.27551153,-0.15798798,-0.9427115,0.63575375,-0.22529861,0.84775436,0.769035,0.9972101,0.26553208,-0.03711382,-0.7145334,-0.34767738,-0.04113857,0.07416896,0.99912995,0.13829778,0.055662245,0.4702832,-0.26324067,-0.5552583,0.8110825,0.16363937,-0.25068453,0.99995923,-0.23640572,-0.9258846,0.1152208,0.99964863,-0.8411108,-0.51446986,-0.9991734,-0.46733373,-0.33765703,0.89811784,0.65757483,-0.085004,-0.61733246,-0.379798,0.2663946,-0.21159205,-0.45096108,-0.3713056,-0.5140142,-0.19638403,0.14963374,-0.9999335,-0.9959802,-0.8019043,0.72650796,-0.12870958,-0.35102224,-0.64683825,-0.374941,-0.83617055,-0.9095586,-0.28257546,0.3815201,-0.9029108,0.61571676,-0.7200988,-0.2781782,-0.7724622,-0.045925498,-0.07950635,0.5067713,-0.9998628,-0.34099793,0.21196836,-0.23847415,-0.56566644,0.4546768,0.97404486,0.9532531,0.820183,-0.622469,-0.5846051,0.001296724,0.16421565,0.94918007,0.61499864,-0.37694257,0.49417114,-0.10066612,-0.51895237,0.7720913,-0.19523993,-0.29341507,-0.47630447,0.82013077,-0.034385085,0.2558078,-0.5137071,0.11466803,-0.59067357,0.023367042,-0.117537774,0.77600867,-0.35059994,-0.21307573,0.039435126,0.97970194,-0.028723055,0.4017203,-0.5739687,0.8213475,-0.9078453,0.998758,0.4635473,-0.4468134,-0.47276503,0.685192,-0.31759304,-0.346044,-0.98612213,-0.8017009,-0.61329246,0.020898437,0.7814515,-0.27882826],
    [167,1,"CC(C)(c1cc(Br)c(O)c(Br)c1)c1cc(Br)c(O)c(Br)c1",-0.7502816,0.13460253,-0.025117725,0.015611475,0.65228045,-0.35547632,-0.40077215,0.40936702,-0.04477684,-0.33826444,-0.8977685,0.53700864,-0.3358418,-0.4003266,-0.022296576,-0.6045933,-0.18046889,-0.38480458,-0.4095852,-0.648453,0.11292709,-0.313798,0.8697178,-0.6358282,-0.38264906,0.8033797,-0.08905687,-0.659709,0.9289048,0.24452959,-0.32281965,0.63357455,-0.24586959,0.3019374,0.26970896,0.058200356,0.5837722,-0.001840042,0.9986779,-0.850304,-0.6243173,-0.18702267,0.15237552,0.230015,0.24193075,-0.50011843,-0.22107038,0.06888616,0.69032943,-0.29992133,0.5144285,0.039069798,-0.28798768,-0.19885652,-0.87345815,0.4863191,-0.89599186,-0.6663159,-0.017134843,0.5381789,0.16817926,-0.66598105,0.34375873,0.28481403,-0.3798928,0.61372757,0.3047779,0.56651956,0.33811834,0.3308144,-0.62319297,0.6993047,0.3465887,-0.5396752,0.86812294,-0.77204454,0.4302636,-0.5985382,-0.73992264,-0.9931768,-0.85030276,-0.022410246,-0.92037684,0.6523339,-0.47406885,-0.9832563,-0.27221206,0.2667744,-0.34267646,-0.8390843,0.5171194,0.02474937,0.2983836,-0.23865011,0.8884407,-0.3511223,0.9219465,0.14496294,0.021522554,0.526982,0.5552266,0.17930561,0.47975495,0.6425576,-0.9920452,0.29616088,-0.10541893,-0.658056,-0.9996592,0.065828726,-0.5972225,-0.066637486,-0.2704573,-0.34047672,0.5578885,0.68060464,-0.10745561,0.21542569,0.99296916,-0.27308527,-0.05035015,-0.5157407,-0.6711504,-0.03331595,-0.84327984,-0.14850624,-0.075785734,0.7127789,-0.24633463,0.99994916,-0.56349474,-0.14279306,0.027310953,-0.40417737,-0.12940432,-0.7943963,0.46338367,0.8776063,-0.6277747,-0.41250262,-0.9999804,0.45325258,0.97804356,0.17004903,-0.4606538,-0.2343322,-0.4160908,0.024359677,-0.75624007,-0.08111619,0.5814813,-0.82619977,-0.023098098,0.1330849,-0.001828464,-0.13393565,-0.25356725,0.08694235,-0.93559283,-0.08338845,-0.8050993,0.039121937,0.5544006,-0.1571385,0.54658216,0.13600713,0.82791495,-0.39593685,-0.46672794,0.11519312,-0.6326278,-0.049888123,0.34451395,0.55263907,-0.061651044,-0.9370434,-0.8948178,0.1797768,-0.09541222,-0.15915094,-0.07906599,0.4358001,-0.48948175,0.19499557,0.70892847,0.39506575,0.39408004,0.07943982,0.054651678,-0.7336105,0.7746471,0.0397423,0.41554657,0.30219543,0.4523823,-0.7504874,0.39542386,0.70113325,0.14631233,0.01754104,-0.8469903,-0.22666964,0.34988785,-0.6955093,0.12452068,-0.3461112,0.42814648,0.013653062,0.72540015,-0.99960274,-0.13538145,0.6321604,0.02084743,-0.17396389,0.5651638,-0.5455962,0.36101165,0.41641742,-0.88782597,0.15765339,0.11487537,-0.7363871,-0.4261019,-0.60349286,0.9999662,-0.3117897,0.048569072,0.410177,0.45221084,-0.42848402,-0.45553672,0.099303484,0.43047208,-0.6920941,0.4604717,-0.15968749,0.46978113,0.14973255,0.18442523,0.13743962,0.80699193,0.84323066,0.19976103,-0.52132404,0.7035128,0.47597215,0.95299524,-0.17301702,-0.40367165,-0.13201885,-0.23829664,-0.9819844,-0.5115985,0.24812183,-0.16530953,-0.5157064,0.1395404,-0.3497895,0.55085695,0.5052893,-0.8350126,0.87497675,-0.24596687,-0.6888561,0.58709437,-0.74902,0.63739693,0.46844506,-0.89613324,0.2066835,-0.7431912,0.99434865,0.4777728,0.6999246,-0.56275976,0.46812457,0.008025048,-0.15540896,0.45040104,-0.7526269,0.8993187,0.99572986,0.261726,0.5900289,-0.63505083,-0.3828,-0.5438101,0.7439727,-0.5998595,-0.07447345,0.35754457,0.92248946,0.1100156,0.5780552,-0.11052603,-0.3641367,0.9999933,-0.99853265,-0.36276153,0.35510647,0.1723066,-0.4355728,-0.38797632,-0.09348022,-0.000306055,-0.9550619,-0.88154227,0.3039634,0.089026764,-0.242015,0.7981099,-0.3489291,0.5159558,0.015631918,0.89309436,0.2544189,-0.09492283,-0.32618776,0.97314775,0.7652857,-0.32184055,-0.29259974,0.35206428,-0.6805158,-0.67863554,-0.3009307,0.647729,-0.9569153,0.3384427,0.56015915,-0.32559967,0.042975448,0.69305617,0.13101289,-0.39857778,0.97531086,0.35131767,-0.16136661,0.21937013,0.012839066,-0.68216145,0.3805449,-0.015016659,-0.84570855,-0.7217356,0.26858124,-0.6411185,-0.60969985,-0.29667684,-0.6829026,-0.91556734,-0.5185155,-0.6172622,-0.40682572,0.2854022,-0.1990343,0.25823462,0.9995988,-0.4742619,-0.018831167,0.24619605,0.25985768,-0.3800782,0.24429949,-0.9695881,0.5035427,-0.049050637,0.742988,0.3890257,-0.111819126,0.28105044,0.9046964,0.70882183,0.10039939,0.56030035,0.98858505,0.6864226,-0.36028197,-0.7460053,-0.3443989,-0.8716896,-0.042173717,-0.7450915,-0.6896683,-0.24853855,0.07044479,0.122906595,0.26418325,-0.5745499,0.7322288,-0.010970072,0.5744135,-0.14637302,0.8060014,0.6985355,-0.41282108,-0.35019135,-0.63516086,0.7050754,-0.7586332,-0.7760297,-0.517642,-0.8530284,0.59612906,-0.5690695,-0.09750549,-0.14597479,-0.6556992,0.6298376,-0.23369011,0.5038579,0.07719059,-0.68044513,-0.01981667,0.015043604,0.63283217,0.8687643,0.3591536,-0.9716946,0.75839555,0.99905485,-0.79714,-0.15429533,-0.98795366,0.045269407,0.19996963,0.69224596,-0.12113234,-0.53860873,0.038284186,-0.2390577,-0.965472,-0.33419788,0.57083434,-0.59246385,-0.4215033,0.47892293,0.54465824,-0.99998224,0.99782085,-0.62798566,-0.38907492,-0.2814766,-0.20290798,0.08980086,-0.8985069,-0.4506518,0.20461793,0.12481891,0.25893983,-0.8945442,0.036030713,-0.20345028,-0.076676056,0.5344467,-0.56465465,-0.5910893,0.54714864,-0.99989814,-0.55708206,0.24568167,-0.010693385,0.22290164,-0.23739547,-0.99183726,0.71617675,-0.6087953,-0.1871734,-0.01599039,0.03938494,-0.019704187,0.97014904,-0.38273746,-0.78386813,-0.47371557,0.60485184,-0.81825256,-0.8900925,-0.14996897,-0.5396605,-0.22078864,-0.70707965,-0.9703183,0.05091437,-0.46761712,-0.7376417,0.72805464,-0.7744997,-0.45772332,0.8057162,-0.6315154,0.07913085,0.5806379,0.98730886,0.13079542,0.14271785,0.051378906,0.019832436,-0.092198834,0.99987966,0.7151682,-0.27400625,0.26986715,0.49546206,0.45237735,-0.23149255,-0.9880426,-0.44285473,0.8637631,0.80869174,0.34807113,-0.6236424],
    [168,0,"Nc1ccc(N=Nc2ccccc2)cc1",-0.17762092,0.08918686,0.48751274,0.62161773,-0.18314517,-0.47653314,-0.5034608,0.62694955,0.18060732,-0.592273,-0.72489166,0.13358562,-0.110863134,-0.64545834,-0.040126096,0.66046613,0.032768223,-0.19591571,-0.34200197,-0.14668776,0.79767966,-0.6945585,0.188813,0.6435705,0.40009624,0.20670474,0.12640435,0.27028832,-0.08166451,-0.39188117,0.101728104,0.10425345,-0.36429098,0.27756155,-0.100879356,-0.1641782,-0.23146012,0.5829518,0.83358395,-0.96269363,-0.9792616,-0.3325207,-0.10827174,-0.4803436,0.47313935,-0.9851321,0.3051285,-0.09376158,0.99452543,-0.3837277,0.11705125,0.38599,0.47117764,-0.5216602,-0.83146775,0.036573477,-0.6984427,0.9200476,0.36945927,0.29792684,0.090362616,-0.2891067,0.5924318,-0.12731723,-0.29518136,0.46049806,0.015476488,0.46387607,-0.04336062,0.6645104,0.5102239,-0.87505776,0.40209508,-0.4188524,0.43549076,-0.3788869,0.13016525,-0.6740341,-0.3008498,-0.9750213,-0.6448441,0.18786295,-0.47096428,0.3137691,0.13672625,-0.72887194,-0.082268655,0.002582868,0.012148635,0.18695724,0.31955934,0.3288755,0.3086519,0.4371892,0.9670726,-0.13107629,-0.4452754,0.32003227,0.44266358,-0.5552101,-0.005463248,-0.83083576,0.14916271,0.9083392,0.43480235,-0.62581164,-0.4460555,0.33056644,-0.7504234,0.22983803,-0.33581468,0.25879383,0.07840323,0.3113223,-0.6541787,-0.5388714,0.6614723,0.41295978,0.99859935,-0.56594926,0.22377324,-0.37439007,-0.3505854,0.031584322,-0.5270833,-0.11081624,-0.14453124,-0.36716387,-0.035592843,0.9997869,0.3320282,0.34137672,0.20351546,-0.19385971,0.02038357,-0.007467068,0.5716106,0.6615846,-0.5390687,-0.26978523,-0.9998473,0.1962918,0.977452,-0.18475097,0.40370378,-0.27078906,-0.5138713,-0.24790274,0.9336727,-0.42078802,0.018482666,-0.40920687,0.02006696,0.000871139,0.03728448,0.55784327,0.22635345,0.99617475,-0.2879232,-0.63478273,-0.98103535,0.28040612,0.070119664,-0.051413413,-0.19270213,0.07934738,-0.35790104,-0.45846376,-0.23510002,-0.03905537,0.14677459,-0.17873698,0.7443074,-0.47387385,-0.24257766,-0.8789628,-0.7848658,0.14058048,-0.41223592,-0.37079918,0.7467476,-0.61184,-0.28129506,0.6830797,-0.73356503,-0.2918554,0.84272814,-0.30193302,0.3261883,0.22221178,0.16428319,0.05218106,0.18197465,0.048377533,-0.35831225,0.31948408,0.4288731,-0.1117202,0.3053287,-0.51970863,0.032725275,-0.6098996,-0.8058718,0.33622485,-0.24705887,-0.15196235,-0.4031129,-0.60803336,0.6781269,-0.99593574,0.03082435,0.2019571,0.115988165,0.05453347,0.5517775,0.0988944,-0.010220707,-0.25649,-0.007518481,0.05620282,0.65514785,0.40097263,-0.3174478,0.08629868,0.97366357,0.32349703,-0.19111519,0.4882761,0.6987738,0.40475318,-0.04295389,-0.44637066,0.7013339,-0.6433793,0.37853026,-0.3112388,-0.4305054,-0.09230328,0.5186822,0.23197097,0.8898052,-0.03403741,-0.05323326,-0.2790993,0.7647548,-0.031205798,0.096334375,0.17195944,-0.6618756,0.060708888,-0.053683802,-0.9655729,-0.06847661,0.80777866,-0.014022976,0.63139874,-0.19497788,0.64039785,0.089315884,0.10417211,-0.32047135,0.78661174,0.23111464,-0.34081656,0.56586826,0.46825445,0.5463224,-0.40104282,-0.9329712,0.4669739,0.03987584,0.28166503,-0.34924158,-0.15447262,-0.20993859,0.9219305,0.19847848,0.40103886,-0.23508736,0.643669,0.16460644,0.9996131,0.12916726,0.571563,0.03813031,0.34709606,-0.06233648,0.30272043,-0.35045668,0.3454871,-0.030500803,0.99899215,-0.35266092,-0.027795332,-0.34120688,0.5649148,0.99995387,-0.9631116,0.4404138,-0.14232188,-0.4694188,0.4478902,-0.644011,-0.60048765,0.5885856,-0.47068176,0.95923567,0.39851186,0.6514501,-0.699148,-0.14598124,-0.048477113,0.47087944,-0.41163483,0.85292614,0.25274622,0.60605806,0.29654238,-0.9890923,-0.28253916,-0.34588942,0.4864165,-0.16702735,-0.909562,-0.4978176,-0.60738665,0.78275585,-0.9231897,0.40787795,0.10821759,0.3543253,-0.41211542,-0.44019973,0.15358733,0.54360145,0.4960165,-0.03286063,-0.48756275,-0.19978659,0.18704529,0.003173734,0.21289597,-0.5806691,0.8500843,0.023552101,0.000163063,0.02597749,-0.30534092,-0.58272177,0.7190034,-0.9966524,0.081234574,-0.32510546,0.36039785,0.5072039,0.65932715,0.47344548,0.9982515,-0.034305654,0.008026492,0.001854577,-0.4820593,0.71265733,-0.014709627,-0.8286433,0.03798289,-0.1433535,-0.77856874,-0.7848029,0.59971917,-0.3362954,0.15953082,0.3226114,0.81801677,0.11296532,0.9987737,-0.17244358,-0.13607797,-0.60433054,-0.54737324,-0.41777122,0.31859645,0.4386279,-0.46736172,-0.14057608,-0.22704221,-0.17973067,0.60695636,0.12725909,0.7578872,-0.23079513,-0.6174302,0.1911635,0.61554384,-0.28874052,0.2568272,-0.25842783,0.08295412,-0.08471679,0.18333387,-0.6790983,0.41263348,0.27200034,0.22182271,-0.06989358,-0.4556309,0.1768137,0.87562764,0.38399884,-0.20219766,0.7850393,0.09200425,-0.65973985,-0.012632584,-0.029891111,-0.12873706,0.99998254,0.21978307,-0.9645684,-0.14944364,0.99876297,-0.43063673,-0.5979132,-0.9993553,-0.09090803,-0.29270494,0.16844817,0.09334758,-0.61185473,-0.54003805,-0.011766422,0.2873367,-0.19293763,-0.7491386,-0.17699984,0.34362411,0.18671587,-0.37083578,-0.9999731,0.9905703,-0.98039395,-0.13354564,0.3535571,0.39789528,-0.7462919,-0.32248825,-0.53614914,0.6244163,-0.20823608,-0.1479692,-0.8347559,-0.19171312,0.44328624,-0.31386322,0.47523725,0.009180852,0.054205228,-0.92023313,-0.9999222,0.06424426,0.044617224,0.17125393,-0.5257453,-0.053647224,-0.9548752,0.15321627,0.117155254,-0.21893488,0.3523551,0.14416334,-0.5132116,0.9626591,0.27025673,-0.039541416,0.054307256,-0.23931527,0.18207845,-0.65058446,-0.5282188,-0.19071592,-0.22372264,-0.08092985,-0.9496953,-0.1448133,0.007545213,-0.23432666,-0.34850213,-0.57132506,0.24230951,0.6764794,0.25418404,0.37174243,-0.08356078,0.15272784,-0.08721558,-0.31446454,-0.46421486,-0.50512904,0.7725456,0.99964505,0.47176617,0.45803574,0.23593137,-0.171259,-0.18593472,-0.024840385,-0.52318937,0.31170624,-0.7154969,-0.5055762,-0.57515943,-0.15077081],
    [169,0,"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F",-0.8151993,0.41435522,-0.95685035,-0.29621774,0.5730916,-0.8299525,-0.2415031,-0.025777116,0.22035725,-0.6193436,0.19775434,0.4674559,-0.42040092,0.8997502,0.22246674,-0.9980189,-0.6590558,0.6324349,-0.08019612,-0.7448701,-0.77513766,0.3314283,0.7758512,-0.6949667,0.79455096,0.6925634,0.48553938,0.30064493,0.97972155,-0.035254765,-0.66246164,0.812608,0.37094578,0.19649842,0.25183618,0.8888507,-0.032546826,0.5448987,0.9998551,0.68320787,0.006251432,-0.3018374,0.28491247,-0.6347489,-0.24127316,0.8663588,0.7737824,0.50688803,0.9826797,-0.5143016,-0.24292596,0.35527453,-0.15666191,-0.59376293,-0.607787,-0.5290687,-0.8543004,-0.99609816,-0.88576376,-0.27157098,0.24498035,0.04914437,0.47149807,-0.36391225,0.06966552,0.5414944,0.019182738,-0.652381,-0.25644615,0.48638532,-0.8279218,0.59834266,-0.370896,0.83504176,0.7550957,-0.8153178,0.8078587,-0.61901575,-0.77216834,-0.99529886,0.2533599,0.64156365,-0.737707,-0.1737602,0.6171866,-0.8901655,0.29039013,0.2655657,0.42962614,0.6629349,0.588738,0.77467877,0.55398124,0.36693025,0.98494494,-0.46461478,0.6072523,-0.03618081,-0.4149652,0.69266456,-0.39606622,-0.33164316,-0.08887064,-0.43152183,-0.9998804,0.70317066,-0.0755213,0.2787606,-0.7432745,-0.48784938,-0.52332085,-0.29956242,-0.88346153,-0.7863392,0.5940375,0.8817034,0.21770063,0.8749675,0.8259669,-0.8090882,0.81984127,0.020913765,-0.1939454,-0.1647718,0.3037541,0.4389216,-0.5877291,-0.090607256,0.21017723,0.9998562,-0.41382656,-0.5002395,0.9176982,-0.668592,-0.31908417,-0.88769704,0.4758509,0.600601,-0.90038276,-0.7559512,0.99944544,-0.38710964,0.79657143,-0.23810159,0.43150774,0.36032146,0.81539595,0.008965394,-0.9992446,-0.18474989,-0.4605674,-0.45812997,0.031224571,-0.68828505,-0.82703185,-0.49787286,0.2572982,-0.9913277,-0.9829821,-0.34307086,0.7773006,-0.4254615,-0.6935768,-0.11187548,0.6301966,0.16827737,-0.7736033,0.5791909,-0.39267537,-0.26047078,-0.9131946,-0.92797637,-0.41985464,0.8896603,-0.4780036,-0.9387228,-0.9001348,0.68537736,0.37045833,0.71117216,-0.8155802,-0.2993698,-0.61844254,-0.9630628,0.97099185,-0.80620784,0.396936,0.74536324,-0.6274744,-0.96588504,-0.13252747,0.79460174,0.728914,0.013073267,0.014562534,0.17191502,0.48575038,-0.6375743,-0.11850836,-0.6331107,-0.8278299,0.5554598,-0.43389857,-0.7726937,0.63127863,-0.19115688,0.5745719,0.7095198,-0.756666,-0.9998942,-0.4761182,0.8428983,0.76331896,0.2734225,-0.92869186,0.45319128,-0.23780215,-0.21664284,-0.2581977,0.37373045,-0.19398029,-0.15422797,-0.2936043,-0.08721986,0.95478964,-0.26037458,0.6056442,-0.12287582,-0.06688933,-0.8601207,-0.62103206,-0.20364521,-0.06912547,0.1677465,-0.6966416,0.61862314,-0.42285112,0.476127,0.038506266,-0.1379057,0.49460006,0.9342488,0.83473533,0.009828952,-0.988876,0.16047256,-0.27289864,-0.10888672,-0.8501972,-0.12538506,0.7619954,-0.9996507,-0.8678804,0.03525478,0.18835281,-0.75291336,-0.48549497,-0.38045624,-0.45184988,0.4258936,-0.3976796,0.43465728,0.08740588,-0.6525488,0.59436226,-0.8119934,0.54124534,0.060430832,0.9622362,0.5509037,-0.8951795,0.9944662,0.7689263,0.6035235,-0.44455057,0.89776474,0.09316886,-0.9219874,0.2235526,-0.99584806,-0.5491143,0.7770135,0.02316357,0.2179135,0.31075132,0.5432162,-0.88182694,0.8663203,-0.8101418,-0.9464577,-0.73210764,-0.6641568,-0.8072055,0.56892455,0.47857645,-0.54112065,-0.99509996,-0.99805504,-0.001329101,-0.19344497,0.35257667,-0.7046435,-0.5432295,0.70068145,-0.58417284,-0.15936126,-0.99895287,0.34285092,0.031980287,0.023489345,0.5518167,-0.42444965,0.03894796,0.63545686,0.67862916,0.82532233,-0.59790593,0.22942804,-0.93081516,-0.31822038,0.2194226,0.77289224,0.87440014,0.48225632,-0.4970956,0.85999334,-0.02526443,-0.9740894,-0.9248299,-0.5106965,-0.79928035,0.22513133,-0.4527545,-0.13844481,-0.03906757,0.98418283,-0.8869604,-0.659198,-0.17606346,0.30569798,-0.78293484,0.48479715,0.8795581,-0.9477514,-0.09948904,-0.74199694,-0.027872443,0.41955867,0.64958024,-0.9754955,0.55009025,-0.32585117,0.77080166,-0.23438719,0.2812864,-0.3196705,-0.4428397,0.9998947,-0.35315064,-0.68702424,0.36245975,0.66900843,0.0143196,-0.5016747,-0.96030354,-0.13230206,0.77041173,0.91837156,0.43964657,-0.23319818,-0.27468097,0.17445105,0.9115398,-0.29329208,0.3616755,1,0.54661375,-0.7527507,-0.02100903,-0.5282038,-0.83084875,-0.17559816,-0.8355571,0.373226,-0.28580594,-0.4547017,-0.5387328,0.8334144,0.69512904,0.64656645,-0.09959383,-0.39166197,0.47896442,0.4299745,0.41488126,-0.99941975,-0.80643815,-0.7092336,0.78215826,-0.5712962,0.5947721,-0.37115365,0.00768702,-0.25726798,-0.1378103,-0.47920293,0.012728998,0.2559459,-0.541727,-0.18477239,0.76384705,0.09266165,-0.11056208,0.6750508,0.7324669,0.826645,0.99981236,0.349866,-0.9940438,0.17295505,0.9976265,-0.9802184,-0.37253967,-0.9990562,-0.3682513,0.15513727,0.11384456,0.21227524,-0.30410066,-0.4135861,0.47790855,-0.970649,0.10715904,-0.4321667,-0.6789699,-0.36779281,-0.3650716,0.07915974,-0.9998731,-0.99999976,0.24057598,0.34634554,0.37796283,-0.3896425,0.54802734,-0.7861716,-0.35071987,-0.36033884,-0.8347651,0.8541353,-0.7127701,0.2266582,0.20413412,0.3379378,0.30636993,0.4990706,-0.7395416,0.9771856,-0.9975343,0.7070963,0.6577618,0.40711525,-0.10915859,0.1210022,-0.91010994,0.21979406,-0.39537445,0.20330553,0.51666766,-0.075144544,0.43547317,-0.94959354,-0.35269782,-0.41400382,-0.34686735,-0.7860362,-0.6388484,0.46094432,-0.5848702,0.08737772,-0.83307695,-0.8481766,-0.9995492,0.21847412,-0.37780702,-0.04146849,-0.16187614,0.38206917,-0.23485088,0.91628677,-0.79480034,0.23460154,0.4526258,0.99943954,-0.37639692,0.85541904,-0.1474275,0.3759387,0.4258287,0.98638165,0.91664225,-0.80972,-0.19796528,-0.43393862,-0.77183497,0.9012535,-0.99901223,-0.034168296,0.551044,0.98601705,0.8893995,0.0775558],
    [170,1,"O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)c([N+](=O)[O-])c1N=c1[nH]cc(C(F)(F)F)cc1Cl",-0.31459725,-0.60484076,-0.3319638,-0.22916156,-0.5397137,-0.49042168,-0.5235595,0.73256296,0.5211875,-0.21790902,0.35811004,0.6780282,-0.3393836,0.94641054,0.25469562,-0.96653277,-0.324346,-0.09677212,-0.30163744,-0.9074273,0.41903487,0.3651268,0.39276135,0.4112365,-0.3308389,0.27822503,0.69904625,-0.25912473,0.61519235,-0.6202931,0.24869427,0.6575582,-0.60757416,0.10116881,0.41647467,0.5536707,0.6706167,0.38206977,0.9994731,0.44349465,-0.2070014,-0.38012853,0.44317508,0.6686545,0.029641282,0.7988315,0.37073854,0.35275367,0.95213395,0.1183235,0.46039316,0.6053463,-0.6192432,-0.472318,-0.6780268,0.22692396,-0.9336519,-0.97432625,-0.41967377,0.7333661,0.3994542,0.8065199,0.010681177,-0.35266986,-0.4952862,0.8962718,0.7730571,0.05523423,-0.013440546,0.15145612,-0.9680538,0.17785907,-0.1269223,-0.7812241,0.11821127,-0.78987485,0.82796055,-0.89784676,0.43701884,-0.9987019,0.06574185,-0.54378563,-0.9024057,-0.7244536,-0.4924415,-0.9285532,0.06678897,0.54975206,-0.8528199,0.68103886,0.53048486,0.28281072,0.15011863,0.6439893,0.99934256,0.20245798,0.043604627,-0.17466944,0.19568962,-0.090243876,0.8712158,-0.49470738,0.32194442,0.16703239,-0.9997063,-0.65668327,-0.629205,0.2737219,-0.84340817,-0.3145098,-0.77837396,-0.2988426,-0.8549093,-0.6124314,0.4642131,0.29501212,0.530289,0.3810638,0.90063095,-0.9204661,0.6318011,0.53255904,-0.36361542,-0.3534979,-0.5812039,-0.3896436,-0.20007332,0.12858263,0.37413713,0.9998814,0.67777616,0.7283264,0.37054607,-0.7371004,-0.71667325,-0.9707695,0.6354831,0.49735612,-0.78606725,-0.67101115,-0.9999573,0.13105632,-0.25956202,0.6037012,0.46403775,-0.64633566,-0.37379882,-0.054241132,-0.997925,0.15120853,-0.66092134,-0.27555993,-0.43430516,-0.17026222,-0.5070945,-0.122658335,-0.3413649,-0.97847515,-0.89012593,-0.59573716,0.44563475,-0.224771,-0.02929407,0.32426894,-0.032047253,-0.042930003,-0.5003681,0.18633752,0.35313097,0.48293334,-0.14077033,-0.48286715,-0.22599798,0.22439866,0.61064255,-0.48304147,-0.83529925,0.12183665,0.29904237,0.6938969,0.5708842,-0.99519914,-0.65812314,-0.510009,0.8326703,-0.5696628,0.47951916,0.868927,-0.8535271,-0.4719397,0.5671122,0.1733009,0.001022832,-0.5695113,-0.19585261,0.13268095,0.5034061,0.96008223,0.4583726,0.6236796,-0.48729628,0.2345365,-0.8438666,-0.10391207,-0.85195905,-0.7973009,-0.22796044,0.36131853,-0.1323851,-0.9994042,0.12195354,0.7948266,0.13946769,0.649444,-0.29311034,0.5340751,0.71355027,-0.5714236,-0.3607845,0.22421153,0.66139734,0.21841505,-0.13591403,0.43349904,-0.91781217,0.3819767,-0.051933467,0.62515146,0.05302177,-0.2507857,-0.31868818,0.03132823,0.43998265,-0.23945454,-0.46713033,-0.02022373,0.3316047,-0.41204926,0.17379825,-0.43308783,-0.9865531,0.8416293,0.81893647,0.1962329,-0.29501653,-0.035391487,-0.25547624,0.19301361,-0.31489456,-0.4222344,0.49799842,-0.97339576,-0.49203813,0.11636796,-0.32208666,-0.672731,-0.15056707,-0.3628108,-0.47864014,-0.21203128,-0.36198333,0.484908,0.6145272,0.1446644,0.6438532,-0.5903313,0.12019416,0.44730344,0.50331724,0.16895486,-0.1769187,0.99909186,0.73275,0.5293205,0.28361216,0.9031527,-0.22957718,-0.22095102,-0.5737674,-0.93313605,0.15723288,0.91089845,0.2567034,0.6975877,0.7739638,0.46960467,-0.80212164,0.8293598,0.14797708,-0.20721933,-0.3900886,-0.5022646,-0.07809381,0.7491384,-0.2406663,0.10675831,0.99997795,-0.9902569,0.6037321,0.16191933,0.79236865,0.6540066,-0.8578223,0.7239161,0.55361605,-0.23053265,-0.996665,0.26945952,-0.12342137,-0.24735215,0.81949836,-0.49079928,-0.16640837,0.19675595,-0.8728672,0.4997075,0.2281859,0.7857714,-0.9747351,0.1870806,0.24553326,0.17737901,0.63094,-0.8552341,-0.8908677,0.22449908,0.5278959,-0.9213045,-0.822076,-0.3302399,0.06429621,0.7124759,-0.7036862,-0.51404816,0.34662998,0.8730211,0.16383876,-0.4914577,-0.7815999,0.68625695,-0.15599096,0.23057969,-0.5671177,-0.7198398,0.6522483,0.034354772,0.56198525,-0.49814028,-0.2736194,-0.9801001,0.01545251,0.20523131,0.09519924,-0.6253478,-0.117195964,0.7147816,-0.6165092,0.9995423,-0.14165741,-0.1641237,-0.09779441,0.019166688,-0.50391513,-0.6928252,-0.9122351,0.24298002,0.10414269,0.6089503,0.05244969,0.55910426,-0.6080889,0.30819008,0.82588685,-0.7475559,0.47682697,0.9880433,0.1930422,-0.22444664,-0.06534944,0.14014296,-0.5487663,-0.46694046,-0.7632338,-0.40905192,-0.32338682,-0.38620505,-0.27442628,-0.32354647,-0.4607968,0.81457984,0.11158892,-0.003229312,-0.24778725,0.64718604,0.18418142,-0.88533217,-0.29283535,-0.14648898,0.64934164,0.17720957,0.9625876,-0.10481214,-0.4804731,0.47422034,0.1533348,0.13740723,0.6094264,0.9749848,0.33921647,-0.3024457,0.7422531,0.4853944,-0.6700098,0.58927375,0.4194425,0.42659393,0.9999411,0.11684244,-0.9878893,0.47713938,0.9986795,-0.8693148,-0.6664157,-0.9992403,-0.39148685,-0.23034051,0.5474267,0.19441675,-0.34600785,-0.66234756,0.5283779,-0.8624384,-0.13923979,-0.690504,-0.035488583,-0.24052209,-0.28242266,-0.1871228,-0.9999661,0.9955205,0.23031679,0.68874377,0.19665362,-0.608439,-0.19105214,-0.37664545,-0.60562754,-0.633635,-0.1515742,0.77640843,-0.77760595,0.8702117,-0.5303977,0.7396634,0.6411298,-0.22972263,0.1854371,0.9738157,-0.9988424,0.2998589,0.26087552,-0.4648106,-0.8514401,-0.1864635,0.27545935,0.914547,0.5967198,-0.25081226,-0.4685933,0.66943747,-0.43547747,0.9412369,0.3583146,0.08358982,-0.28816965,-0.15438166,-0.6610908,0.13939108,-0.22464027,-0.710973,-0.37971777,0.25485045,-0.99459845,0.23689379,-0.616799,0.5014009,-0.2448798,0.5676556,-0.05355387,0.8701921,-0.05867651,0.6256135,0.3595896,0.99859196,-0.48456103,0.16704006,-0.776654,0.8432295,-0.3327684,0.9863185,0.6971062,-0.38876754,-0.51334363,0.29691607,-0.8845231,-0.11213689,-0.9961488,-0.122269034,0.43711144,0.74917585,0.11770457,-0.5754189],
    [171,0,"Cc1cc(SC2C(=O)CC(CCc3ccc(N)cc3)(C(C)C)OC2=O)c(C(C)(C)C)cc1CO",0.74341094,-0.005028202,0.43474582,-0.25621623,0.65837324,-0.10125083,0.33894882,0.44346508,0.69617337,-0.5644476,-0.6995503,0.51069856,-0.39535362,0.77184325,0.17715664,-0.6866586,-0.8191542,-0.7093135,0.03415141,0.52478194,0.28733048,0.539628,-0.12509273,-0.1777625,-0.33061332,-0.049572024,-0.0542277,0.6087721,0.3366635,0.063504495,-0.50857556,-0.62267846,-0.11200555,0.2894817,0.3349508,0.447936,-0.46094462,-0.32807603,0.99983174,-0.14290324,0.8746757,0.7112534,0.102528274,0.37471548,0.23012833,0.9828366,-0.2420658,0.33409742,0.88308835,-0.37003508,-0.47940966,0.6842453,-0.020022905,0.6462573,-0.34155083,-0.3555209,0.35419944,-0.9860651,-0.004012027,0.31868112,-0.5539059,-0.16850267,0.14467913,0.56394714,0.6907861,0.10767308,0.13221861,0.010333887,-0.19171782,0.040527932,-0.8286317,0.2871293,0.3171329,0.072268546,0.62453455,-0.04907055,0.4822388,0.07833425,0.76011926,-0.99753803,-0.46981418,0.008034975,-0.9663397,-0.30467644,0.069943056,-0.9645734,-0.22165626,-0.036943864,-0.42123276,-0.07809749,-0.04554385,-0.14973581,-0.43009475,-0.47786322,0.99857974,-0.30241188,0.3886729,0.6477653,0.5883945,-0.48064193,-0.16862608,0.5481198,-0.57693523,0.891791,-0.99994844,-0.5680258,-0.12375979,-0.48959827,-0.99964803,-0.42699295,-0.24310471,0.4811962,0.08764126,-0.15284804,0.452673,-0.12118719,0.7839138,-0.031119432,-0.2788971,-0.15336657,-0.033855394,-0.2918418,0.62679124,0.07432802,0.34270614,-0.02639676,0.2989086,0.035689108,-0.15966387,0.9999435,-0.5865109,-0.023462834,0.3297876,0.5734723,0.35568723,-0.43210584,0.36885667,0.320314,-0.7697721,0.24635246,-0.9999993,0.643904,-0.24534012,-0.6898621,-0.3236737,-0.40658334,-0.5935612,-0.6243324,-0.9998767,0.032968402,-0.1499316,-0.8389187,0.38134047,0.16739799,0.58194107,0.62849325,-0.14366014,-0.99848956,-0.9328737,-0.60589606,0.8853175,0.7740626,0.1869208,-0.24389555,0.10181261,0.11934637,0.7700158,-0.69086325,-0.2582086,-0.39134988,-0.48377976,0.09491533,-0.49166062,-0.27326986,-0.49993265,-0.85909736,-0.17808798,0.4749766,-0.5968765,-0.56064755,-0.4214933,-0.93531734,-0.20763598,0.36039126,0.97497123,0.5450139,-0.32859102,0.5805338,0.08708294,-0.57071275,-0.15769783,-0.33940735,-0.3426323,0.70313185,-0.7688789,0.17697464,0.1750239,-0.33069795,-0.59061986,0.20576186,0.32737112,-0.7557983,-0.39047807,0.3831048,-0.2287048,-0.2527339,-0.4651251,-0.13607949,0.509589,-0.99992,-0.79623497,0.15168835,-0.024792096,0.24513067,0.25381634,-0.16490754,0.31493807,-0.052130733,-0.24170908,-0.44227183,0.20018137,0.12939094,-0.133377,-0.033066083,0.99998766,-0.41164175,-0.14474274,-0.21220224,-0.081388,-0.7275458,0.19826685,-0.3678253,0.8826721,0.65283924,-0.42793047,0.16845776,-0.101610735,0.4040722,0.16368106,-0.051785465,0.8399516,0.1616883,0.4236984,-0.075743444,-0.4415806,-0.30791217,0.061712854,-0.6133034,-0.417465,-0.09279542,-0.054862928,-0.823031,0.62655544,0.38858807,0.22069305,-0.8031254,0.4548903,-0.18911672,0.62952113,-0.61930776,-0.5201544,0.7163032,0.42810178,0.12912007,0.4445229,0.3686522,-0.28210866,-0.8619871,-0.873644,0.2368964,-0.6290668,0.9996362,0.22206564,-0.3478383,0.040587865,-0.22679634,0.12503293,0.070813365,0.2243489,-0.42117393,0.4142598,0.31671757,0.06897257,-0.37334406,-0.54306406,-0.19873002,0.4632386,0.7371516,-0.9193472,-0.7262102,-0.114287525,-0.9710124,-0.3128761,0.3138959,0.24741444,0.08856467,0.9999985,-0.9928656,0.17063524,-0.30649626,0.047352977,0.5578568,-0.7947764,-0.7593459,-0.5578245,-0.8038045,-0.9997747,0.5015616,0.86920184,-0.005532174,0.2536162,0.013672753,0.29679456,-0.2778407,-0.10375262,-0.099184014,0.5539677,0.3690752,0.9386807,-0.43707234,-0.19120272,-0.26415557,-0.23944426,-0.6815446,0.22009687,0.6752026,0.22065537,-0.5531149,-0.14837755,0.003611757,0.45442143,-0.683667,0.51503664,0.6999756,-0.073758826,0.9150291,-0.7807841,0.71452767,-0.35667384,-0.090602666,-0.46282867,0.2905585,0.27540964,-0.71449804,-0.31984383,0.044570543,0.107033215,0.3129468,0.39999425,-0.9945658,0.770999,-0.5039251,-0.37395355,-0.6986951,-0.5037983,0.4218881,-0.30676663,0.9976233,-0.24157484,0.60358113,-0.63757175,-0.20537814,0.40230578,-0.10820092,-0.9446062,0.11376177,-0.26771447,0.35460708,-0.3514197,0.2246027,-0.44177267,0.12015975,0.62334245,-0.9173402,0.12151791,-0.9859406,-0.25660044,-0.23204562,-0.029384073,-0.013352557,0.35508493,0.22196133,-0.04067792,-0.44868052,-0.80958235,0.81488883,-0.024404088,-0.020460732,-0.46275207,-0.013403769,-0.1211259,-0.1184595,-0.45439327,-0.49103418,-0.017688574,-0.29442745,-0.07151193,-0.7890455,-0.61483866,-0.37695232,0.94119895,-0.26179108,-0.28181484,-0.12671198,0.22226466,0.28594345,-0.42758545,-0.66684943,-0.023859266,0.008554893,-0.30718806,0.85800654,0.23278488,0.5974796,-0.7473791,0.018884895,0.8112164,0.29508036,-0.9917294,-0.31193024,0.9948518,-0.001987633,0.61222404,-0.97572845,0.6785978,-0.800764,-0.5514136,-0.5279714,-0.31428382,-0.20424572,-0.4501603,-0.8970364,-0.262721,-0.15992336,-0.39510718,-0.6020926,0.5373776,-0.64528584,-0.99708706,0.9999979,0.9337873,-0.6518625,-0.40162858,0.07962555,-0.016661024,-0.38499582,0.5535712,0.73331153,0.30066776,0.44814518,-0.5564887,0.23702595,-0.11464103,-0.21589008,0.8385235,-0.4265839,0.7190532,0.99842745,-0.9672626,0.16123392,-0.33498687,0.1294785,-0.6011008,-0.69195426,-0.021478299,0.28715086,0.043762706,0.16672961,-0.10251349,0.3959653,-0.028215703,0.9822599,0.5188254,-0.44254428,-0.039118376,0.22181638,-0.05131417,-0.22220336,-0.078145616,0.18992436,-0.08654133,-0.088858925,-0.99777716,0.8211881,0.39348346,0.58239985,-0.014645848,-0.16819033,-0.20087804,0.6253627,-0.40826672,0.68423164,0.4983361,0.9996802,0.2098575,0.26848763,0.72734797,-0.54284203,0.51928914,0.999487,0.35198,-0.2561694,-0.835136,0.10188271,0.45145962,-0.09623623,-0.99944854,-0.70092976,0.5960248,0.43612456,0.5812944,-0.49454153],
    [172,1,"CCOP(=S)(OCC)Oc1nc(Cl)n(C(C)C)n1",0.9734473,0.30122527,-0.663148,0.05156813,0.3117311,0.48942468,-0.9230498,0.15701383,-0.67660284,-0.08816754,0.16923171,0.084746234,-0.7183205,-0.041303195,0.51585054,-0.77659446,-0.62300116,0.41843173,-0.23665397,-0.17459811,0.32259598,0.5449447,-0.054396223,-0.11869627,-0.69322824,-0.15222846,0.23770466,0.59007066,-0.6051148,-0.06372675,-0.24806142,-0.41195977,-0.56721294,-0.5732106,0.5609251,-0.3928973,0.094468385,-0.8233919,0.9897366,-0.7177483,-0.9759908,0.327536,-0.057914503,0.5407783,-0.5287755,-0.80932105,-0.58115065,-0.285355,0.9628505,0.04561674,0.62900156,0.056911997,0.103613645,0.15826765,-0.46543622,0.38403463,-0.5310901,0.14336734,-0.0025564,-0.2052089,0.56048584,0.56168985,-0.4619704,-0.65619266,-0.8608916,0.40485135,-0.04267162,-0.42656773,-0.2829813,-0.23148404,-0.9416255,-0.9515683,-0.10796779,-0.22074448,-0.45900095,-0.89208376,0.01916978,0.077445626,0.3661161,-0.99979603,0.65178066,-0.012036443,-0.9587448,-0.12872799,0.73833257,-0.55766004,0.17299338,0.62979704,0.03846183,-0.23519588,0.14454016,0.09648389,0.03967757,-0.20063864,0.9996453,0.30033383,0.19367239,-0.2734353,-0.21180171,-0.64164263,-0.087278694,-0.14106123,-0.48569402,0.28829193,-0.88656723,-0.9912481,-0.14386703,0.5137939,0.9696168,0.4063452,0.28691104,-0.73968565,-0.4120296,-0.51679224,0.7025367,0.013222619,-0.1798467,0.33381084,0.9983822,-0.17094427,-0.40445018,0.59229434,0.7568875,0.338988,-0.6516434,0.30427936,-0.13478203,-0.65989417,-0.2589582,0.995441,-0.7270654,-0.5738697,0.19950286,-0.5365319,0.44632664,-0.9849351,-0.63045686,-0.24977715,-0.08045272,-0.24250571,-0.9995983,-0.58961856,0.6323223,0.08688266,-0.55552983,-0.5479726,-0.61009514,-0.3716455,-0.026374804,-0.19822563,0.8123706,-0.8815915,-0.069594845,0.15951481,-0.50290805,0.030556481,0.65918875,0.9470318,-0.71572965,-0.9381198,-0.9199618,-0.6577828,-0.29348135,0.42859426,-0.57438034,-0.7645921,-0.17145568,-0.26810357,-0.1438436,0.043417595,0.61122584,0.264388,0.091984935,0.03768463,-0.32242042,0.19897737,-0.472642,0.60940295,-0.86494094,0.7768148,0.31216335,-0.97121763,-0.12703063,0.8384451,0.3610985,0.60544735,0.5003927,0.6941413,-0.42888275,-0.61499417,0.35880336,0.34554562,0.5152167,0.5380817,-0.15954082,0.49524173,-0.45447713,-0.851193,-0.24071312,0.5945393,-0.2223723,0.34276533,-0.6506179,-0.4507528,-0.64075005,-0.43413365,0.17669362,-0.73698574,0.4040365,-0.99921745,0.007776921,-0.013865013,-0.88830805,0.62281907,0.7292868,-0.10651623,-0.8606407,0.3812854,0.49453288,0.4072333,-0.062852114,-0.5259515,0.7827954,-0.10591469,-0.9810814,0.16910677,0.60694736,-0.5636941,0.056778498,0.7227102,-0.065080665,0.6422526,-0.5431914,-0.038564328,0.04657057,-0.029643845,0.23684971,0.39884153,0.53983235,-0.10453922,0.86219347,-0.10970525,-0.45549735,0.4299122,-0.37853697,-0.4271562,0.5368363,-0.48117924,-0.4408264,0.3096733,0.41886365,-0.99819916,0.1642651,0.75517714,-0.46246314,-0.58329284,-0.27401394,0.078856096,-0.6684104,-0.584009,0.36853042,-0.05605819,0.38846266,0.1906007,0.25720108,0.20569281,-0.64884144,0.68262106,0.71668094,-0.43634808,0.7935481,0.99852484,-0.38426587,0.82963306,0.87142164,-0.8913639,0.59691864,-0.07496529,0.16147731,0.10496046,0.24766447,0.99756473,-0.7885902,-0.04705028,-0.6809924,-0.28643072,0.61263704,0.7519907,0.9427748,-0.88303214,0.7090252,0.99463534,-0.5121742,0.85967594,0.37129983,-0.20760264,0.9992899,-0.88338107,0.13893494,0.65889555,-0.5250778,0.84236497,-0.34585056,-0.19846076,0.74033284,0.9222247,0.33854938,0.6922449,-0.16178158,0.48350218,0.51523936,0.41151735,-0.21808085,0.06883526,-0.14079536,0.361768,-0.09549926,0.2797179,-0.9999569,0.64453954,-0.41499227,-0.7040533,0.2649482,-0.9103561,0.8449299,-0.6037263,-0.08466362,-0.28748542,-0.15498678,0.6358672,0.21891479,-0.47411352,0.54277474,-0.016719198,-0.68256867,-0.27852288,0.11954096,-0.60143095,0.03031055,0.10212662,-0.25875634,-0.19504468,-0.14518514,0.16682869,0.087153144,-0.6221948,-0.18382102,0.7497931,0.28017712,-0.11082042,-0.94409263,-0.8372679,0.15015137,-0.43042392,-0.39449733,-0.19444706,0.37774262,0.9995341,0.078541495,0.4171463,0.4606442,0.42855796,0.5178097,-0.8208366,0.18873286,-0.29868156,0.2865675,0.56407344,0.5434521,0.0976144,0.16624844,0.4851374,0.39739743,-0.70046794,-0.35266456,1,0.35916424,0.16898258,0.006060801,0.053871866,0.08910196,-0.24676761,-0.21928366,0.6880397,-0.23457843,-0.20630136,0.48416814,-0.4750298,-0.82540286,0.69980717,-0.101514645,0.55524117,-0.6098202,0.46747336,-0.2437551,-0.8860506,0.57466084,-0.33653903,0.4195788,-0.25794554,0.84479827,0.39703515,0.001684413,0.3817899,0.307096,0.321554,-0.18517165,0.574681,-0.14998843,0.107908145,-0.6741414,0.33197862,0.35488567,0.26644632,0.26418176,0.53755945,0.9999999,-0.70660025,-0.94014764,-0.29273582,0.99774474,-0.18462676,-0.77408516,-0.9999324,-0.28426033,-0.76705766,0.002963318,-0.8190913,-0.29449818,0.49431255,-0.7116854,0.40346247,-0.48844165,0.7696335,-0.7416252,-0.6632271,0.009954064,0.11334785,-0.9999564,-0.9946026,-0.95520055,0.41016167,0.6007933,-0.60352546,0.20395339,0.3779049,-0.4701028,0.3747441,0.5813116,0.44627732,0.31889158,-0.11433701,-0.09393306,-0.00074468,0.85885096,-0.13969007,0.38728768,-0.5513588,-0.9997882,-0.2834702,0.21869181,0.5049964,0.598722,-0.31641892,-0.28972203,0.75148755,0.742848,0.23778334,0.123761624,-0.8829791,-0.054376848,0.89930534,-0.5173843,0.11167434,-0.37437534,-0.3579785,0.14765814,0.5987396,-0.5910856,-0.34718844,-0.71853304,0.76080424,-0.9304672,-0.52005196,-0.25514072,0.3128675,0.09604016,-0.23968054,-0.14986424,0.51262116,-0.48139668,0.2677341,0.190567,0.86865026,0.40595677,0.12858531,0.41139364,0.06171375,-0.34968662,0.9999744,0.81648934,0.4996406,-0.5271204,0.62855333,-0.44690406,-0.0947433,-0.98360735,0.14591996,-0.47873035,-0.06514517,-0.8042235,-0.27543834],
    [173,1,"O=C(c1ccc(O)cc1O)c1ccc(O)cc1O",-0.10755595,-0.16288768,-0.06810666,-0.3869837,0.62892294,-0.15286537,-0.59248126,-0.4391551,-0.06912219,0.27203986,-0.6032014,0.05314202,0.38772196,-0.59235924,-0.10112807,0.7287112,-0.48071662,0.3038686,-0.036939505,-0.23383348,0.19143936,-0.7666656,0.5110955,0.39419034,-0.055883035,0.41865653,0.41880807,-0.30831355,0.5959061,0.19652463,-0.50739974,-0.4032939,-0.56148875,-0.32989886,0.14152399,-0.5768718,0.37289047,0.24045186,0.9847714,-0.6714239,-0.3954479,0.2942952,-0.27965117,-0.27202737,0.42531863,-0.94728386,0.1963699,-0.4952675,0.7606824,0.5826845,0.5758404,-0.17550956,-0.025387375,-0.2902061,-0.54841006,-0.34003058,-0.6781283,0.5516778,0.47327504,0.573222,-0.4345675,-0.18872738,-0.49134338,-0.65203786,0.01794883,0.3446615,-0.6571236,-0.050998677,0.07447318,-0.33610508,-0.48129022,-0.9893438,0.30438438,-0.37993628,0.4974199,0.39928192,-0.67060167,0.000649766,-0.11652866,-0.983742,-0.9929004,0.029377552,-0.9028802,-0.085506134,0.1120658,0.04604536,-0.06988125,-0.66020495,-0.2316024,-0.24347353,-0.11583385,0.5829637,0.07613847,-0.042574137,0.9964184,-0.23427436,-0.543745,-0.31428838,0.07277872,0.12030633,-0.37255833,0.38103423,0.142596,0.77318704,-0.7996455,-0.5468591,0.38718447,0.050945465,-0.9999997,-0.15023862,-0.59376836,-0.58150256,-0.8963456,-0.3315082,0.57126564,0.7549413,0.39668337,0.3086092,0.99817616,-0.26691425,-0.4828475,-0.44038478,-0.6210372,0.23319669,-0.85469675,-0.19577445,-0.3346377,0.15235966,-0.12249246,0.99111134,0.09080933,-0.008496835,-0.1444372,-0.03807449,-0.7967999,0.84818137,0.48992163,0.7675637,-0.72937,-0.6432125,-0.99968284,0.41580176,0.82645494,0.15380134,0.25288767,-0.24459927,0.13477181,-0.35504442,0.23039575,-0.25469068,0.28942466,-0.93233484,0.22565445,-0.15173668,0.091838434,-0.12960657,-0.12948945,0.9262795,-0.81303895,0.023645159,-0.97974324,0.33740374,0.26175386,-0.29806888,0.14694569,0.5557748,-0.20847104,0.3400342,0.05875031,0.11601641,0.023206852,-0.09581794,-0.103660986,-0.20047021,-0.060588308,-0.92240924,-0.8602429,0.39815846,-0.48062655,-0.11910332,0.40102512,-0.9694085,-0.22974935,0.2877464,0.28028882,-0.35025156,-0.36773717,0.31767294,-0.71225905,-0.0587131,0.87970454,0.14530371,0.119546056,-0.12690312,-0.039696585,-0.86036104,0.34649998,0.9406058,-0.17001536,-0.2758607,-0.69414264,-0.2807313,-0.4173118,0.5168347,0.4234634,0.032677144,0.57773614,0.35020834,0.25989625,-0.9996459,-0.39758646,0.15458478,0.21253091,-0.27293283,0.18817885,-0.27782753,0.21133012,0.36103684,-0.40879798,-0.18869084,-0.43516946,-0.3234225,-0.08897828,-0.003484892,1,0.08907836,-0.24890743,0.81177783,-0.013534335,0.43097246,-0.6328651,-0.40354636,0.38602135,-0.44949844,-0.2646011,-0.36376426,-0.51336956,-0.27899864,0.43405265,0.51323944,0.7834749,0.4176094,0.366401,-0.74938035,0.6019258,0.46156225,0.5739734,0.39922178,-0.1399546,-0.5199854,-0.5235441,-0.96888435,-0.27844483,0.693105,0.3665427,-0.7231075,0.12638402,0.44394705,0.59342384,0.5852948,-0.22336002,0.61555034,0.17677936,-0.07647144,0.44619894,0.025776118,0.21453041,-0.01149639,-0.99092513,0.52565914,-0.28092673,0.91154003,0.5499415,-0.278678,0.25846457,0.8636384,-0.33092022,0.5595914,0.28390825,0.11809352,0.51052094,0.9987335,-0.116803534,0.21624026,-0.000324052,-0.48610148,-0.17659374,-0.9788041,-0.96769345,0.11263915,-0.1141808,0.99397135,0.056131493,0.29213342,-0.11748953,0.072750196,0.99992675,-0.66412944,0.30335474,0.25704136,0.65207773,-0.19558649,-0.70623714,0.55240124,-0.09955056,-0.9122124,0.25069594,0.13586581,0.31220645,0.26957598,0.49836755,-0.61628896,-0.073712915,-0.13425225,-0.32517236,-0.5764219,-0.20145912,-0.5479573,0.99999833,0.47206813,0.001690639,0.08603722,0.06994258,-0.8099392,-0.44250995,-0.11234532,-0.10078656,-0.27396592,0.22040807,-0.32027277,0.25842232,0.03386812,-0.0884926,-0.29354873,0.38622987,-0.69025624,0.248837,-0.26603788,-0.5890409,-0.29770124,-0.33913913,0.3505978,-0.34723216,0.21185185,-0.12609872,0.19245288,-0.2535157,-0.8365949,-0.2992937,0.31855538,-0.96975243,-0.27401698,-0.34311983,-0.2730402,-0.0628965,0.3649173,-0.25202492,0.9997299,0.074388064,0.90056473,0.070990235,0.4242499,0.31931803,0.12010361,-0.5976049,0.033471096,-0.3226597,0.2207808,0.4529014,-0.04928733,0.16169119,0.32014495,0.6128743,0.7193639,-0.097533844,0.9945579,0.75545186,0.48779422,-0.04594314,0.18596688,-0.67862123,-0.16897763,-0.720025,-0.5734711,-0.15892844,-0.59856504,0.41494724,0.020499049,0.20342343,0.75670946,0.22147653,0.5670022,-0.4185801,0.3074831,-0.31105384,-0.4986632,-0.28881937,0.74447113,0.6150093,0.53707516,0.6103079,-0.12572812,-0.16384454,0.04247726,0.07301968,0.24433035,-0.73887545,-0.52269226,0.44883138,-0.16266116,-0.2091648,0.6409072,-0.16687658,0.0910101,0.80016637,-0.27175647,-0.9992184,0.27399608,-0.99407744,-0.3963537,0.99909115,-0.57976973,-0.34175077,0.22252099,-0.08447048,0.72633463,0.62993455,-0.2073386,-0.30944756,-0.008531213,-0.08350201,0.08452093,0.070016064,0.47835046,-0.6771435,-0.44046962,-0.25896907,0.08891803,-0.9999669,0.98933196,-0.92940724,0.32310462,-0.31728053,0.9588552,0.099376515,-0.89577675,-0.7121614,-0.1549925,-0.46945137,0.3501226,-0.8665557,-0.3496932,-0.6253146,0.08244824,0.6910337,-0.059685964,-0.17430902,-0.7160663,-0.999913,-0.7442054,-0.32263008,-0.06956972,-0.03598297,-0.24837194,-0.16594599,0.6880515,-0.8359654,0.09998935,0.029881617,-0.067272305,-0.5341399,0.96591413,-0.34415668,-0.73655236,0.742281,0.56058174,-0.37948728,-0.94360244,-0.31149104,-0.33933207,-0.2851309,0.84761655,-0.82513654,-0.001999609,-0.38509443,-0.3212225,0.015771283,-0.78447974,0.1144918,0.7019334,-0.5983209,0.25867882,0.20049083,0.9185283,-0.003866401,-0.27550715,0.3654991,0.088058606,0.014740254,0.9997971,0.11169573,0.030635117,-0.710768,0.3829272,0.34774527,-0.69564724,-0.9622998,-0.11328633,0.25124076,-0.70869815,-0.049155947,-0.49289295],
    [174,1,"O=C1CCC(C2CCCCC2)CC1",0.119229674,0.2654494,-0.64060867,0.09064114,0.2327583,-0.030618863,-0.17710225,-0.104542084,0.000886105,-0.18945108,-0.27794376,0.12297795,0.006634527,0.44447064,0.26842415,0.3702018,0.10708022,0.07356635,-0.3032379,-0.60957265,0.2777587,-0.50469095,-0.110832386,-0.5131058,0.32273552,-0.055916917,-0.21615437,-0.048153676,0.41555724,-0.5814641,-0.084571585,0.66184574,0.31981748,0.38710898,-0.05079016,-0.3316948,-0.557164,-0.48642918,0.2768943,-0.8771461,-0.98996997,-0.61264354,-0.07434356,-0.18096103,0.17208576,-0.9930507,0.38777635,0.06858046,0.9940727,-0.215854,0.3266808,0.26609036,0.023149358,0.25146127,-0.88161516,-0.50787777,0.4863413,0.95904505,-0.1471514,-0.445886,-0.22043341,-0.5857783,0.4559967,-0.052971598,0.48681214,-0.16701597,-0.27657098,-0.08767928,-0.18563251,0.44927615,0.8996573,-0.7556463,-0.19967179,0.8598081,0.45566297,0.27308422,-0.09198707,0.3159453,0.5660149,-0.99939406,-0.34208304,0.008626631,0.50667036,-0.48357457,-0.35964146,-0.4844485,0.32906458,-0.14330034,0.08924445,0.24323323,-0.44868526,0.5147848,-0.06553761,-0.112778924,0.7557151,0.25504643,0.6204041,0.088817514,0.5047361,-0.3131533,0.27161074,-0.17125827,0.102818154,0.8750578,0.7330996,0.34993932,0.089513615,0.16581881,0.9857801,0.44053155,-0.3803849,0.086528964,0.14281797,-0.10810351,0.19597776,-0.053685088,0.49292937,0.15043993,0.99854124,0.5409251,0.09757642,-0.07304664,0.17123587,-0.037126858,0.025162196,0.33657476,-0.010496725,0.4417638,-0.077996336,0.9998779,0.40761292,0.40150973,0.3363134,-0.5073995,-0.4826765,-0.873391,0.11371728,0.55257446,-0.08674389,-0.13677889,-0.9999134,0.033129215,0.98964864,-0.23022985,0.46307766,-0.5532316,-0.09680112,-0.21336235,0.9782721,-0.16556294,-0.14293022,-0.8488345,0.7580004,0.77964497,0.1786383,-0.28702542,-0.13065334,0.9974603,0.29428768,-0.9625772,-0.99027205,0.27047154,0.028296346,-0.33662543,0.3503328,0.3647648,-0.56450677,-0.29115835,-0.22153357,0.03265006,-0.50542015,-0.41626504,0.41062713,0.013949372,0.52444464,-0.98825806,0.98301405,0.557347,-0.004052804,-0.0473035,-0.21149081,0.09133979,-0.516824,0.6445884,-0.93412864,-0.27091104,0.21477713,0.14511998,-0.07106233,0.7581029,-0.29003122,0.39960703,-0.09202692,0.24895626,-0.18018517,-0.23179688,-0.090931766,-0.78628594,0.71011055,0.3828068,-0.5269232,-0.5481443,-0.4646209,-0.11797119,0.02019607,-0.18846074,-0.31336567,-0.48772106,-0.29905406,-0.97008824,0.21791631,-0.03348688,0.5578249,-0.76996493,0.021188952,-0.11159392,-0.46431246,-0.023204867,-0.04020243,-0.271,-0.48744094,0.546314,-0.57604337,-0.21775548,-0.97559685,0.8135,-0.49191839,-0.25771233,-0.35648438,0.3003139,-0.56073874,-0.62922096,0.684473,0.023282485,0.014939233,0.35674703,-0.62753546,0.52117497,-0.20285901,0.55277145,0.8607031,-0.06966539,0.4355306,0.021314835,-0.76336306,-0.03653437,-0.007353724,-0.57106215,-0.21832879,-0.57182544,0.2534886,-0.964821,-0.26616544,0.6280335,0.43775973,0.51515687,0.5625874,0.49588978,0.15730682,-0.57253003,0.26048154,0.43858138,0.052980483,-0.57349527,0.7564722,0.41232702,0.22921465,-0.3440745,0.8523495,-0.16977033,-0.7752103,-0.18602964,-0.21322958,-0.09030432,-0.2291287,0.852025,-0.24612053,-0.50169694,0.19455127,0.6386357,0.2811992,0.99959797,-0.017647324,0.20018417,-0.027960759,-0.3021333,0.4484081,0.77427053,0.9094866,-0.02289841,0.3662245,0.99902874,-0.17701921,-0.2589186,-0.35061374,0.59156334,0.99988496,-0.9942413,0.26316497,-0.37031314,-0.15115976,-0.5770143,0.4120753,0.20145775,-0.245597,-0.8820945,0.9836777,-0.09530649,0.6042922,0.28659,0.40203446,0.51647264,0.36974204,0.008147197,0.8553538,0.2763417,-0.14582236,-0.16631779,-0.99995154,-0.025367739,-0.4060187,0.40225384,0.30069658,-0.7345278,-0.118872024,0.05952171,0.54727614,-0.9613761,0.17324366,-0.38209996,0.05634822,-0.36718214,-0.1969436,-0.26422548,-0.15551168,0.75949174,0.037115116,0.22627188,0.5444064,0.478908,0.6593467,0.60666335,0.5760037,0.60940516,0.3502318,0.4869519,-0.26872322,0.000445358,-0.5913224,0.8754092,-0.9968343,0.22937328,-0.4181357,-0.18318368,0.14046922,0.39881673,-0.26774773,0.9980237,-0.6244613,-0.20137563,-0.14180845,0.21631889,0.60776263,-0.025427807,-0.61405903,-0.65243596,-0.23215602,-0.4762733,-0.01315432,0.02432179,-0.5658546,-0.23742224,0.0963146,0.9312312,0.34510568,0.99663687,0.12326909,0.35656604,0.4677879,-0.39398032,-0.7331563,-0.14617355,0.41702098,-0.50958437,0.31922632,-0.29450876,0.28553522,0.060897406,-0.42953882,-0.8097332,-0.18091553,-0.43679348,-0.5800821,0.47934812,0.5457988,0.5171291,-0.46127275,0.20192198,0.45466205,-0.10400391,-0.93044865,-0.40105852,0.087447815,-0.050811294,0.31146443,-0.37602353,-0.5664963,-0.6138634,0.057071183,-0.060230136,0.3500143,0.19442035,0.12065605,-0.3135912,0.00671555,-0.15506555,0.99999964,0.7298264,-0.6975426,-0.1966524,0.9948797,-0.07459059,-0.49638948,-0.9998976,0.27004483,-0.11244369,-0.112460636,0.22072284,0.001399103,-0.35706338,0.4038773,-0.6206028,0.04117064,-0.5374812,0.5349417,-0.22621109,0.25926188,0.3625784,-0.9999551,0.99167806,-0.9767883,-0.27975678,-0.5364778,-0.004272396,-0.27967364,0.27513358,0.42436662,0.394292,-0.2631707,-0.29212865,0.026709583,-0.019577306,0.55523664,-0.466433,0.6865202,0.6698372,-0.31940228,-0.9719419,-0.9998852,-0.65210557,-0.36696962,0.28725755,0.26985386,0.15636846,-0.9936657,-0.6694018,-0.07076826,0.39052683,-0.32967067,-0.014524533,0.4356871,0.1634577,0.2964247,0.8015371,0.38379484,0.35821292,-0.6370286,-0.5204388,-0.050041806,0.010870782,-0.18575436,-0.37079594,-0.25710928,0.29419422,-0.30238983,0.37584525,-0.43762112,-0.5925409,0.2584156,-0.9740665,-0.08422171,0.012063088,-0.17013934,-0.6210476,0.21759382,-0.640314,0.11063926,-0.2948562,-0.015285904,0.99953854,0.12353503,-0.41016296,0.564232,-0.256804,-0.47160935,-0.5822316,-0.4114478,-0.1722372,0.054149505,-0.40158486,0.7050316,-0.073846824],
    [175,1,"CC1(C)NC(=O)N(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1=O",0.6558923,-0.11403653,0.5208564,-0.7083123,0.23404635,-0.89344573,-0.714648,0.25691047,-0.17540222,-0.0957,0.15040684,0.2315168,-0.2334855,0.9109315,0.5003419,-0.75675493,-0.0354553,-0.21200019,0.008747694,0.08709474,0.4743677,0.19651236,0.63057494,0.18733051,-0.015671026,0.2758195,0.3381393,0.53837067,-0.003990379,-0.40974927,-0.36565626,0.43513057,-0.30051428,0.27262443,0.25353575,0.077550486,-0.18535174,0.6358342,0.996924,0.23182364,-0.9792461,-0.22841683,-0.36709252,0.6080709,0.026922874,-0.7434091,0.17752257,0.7215123,0.18098415,-0.0503859,0.43598205,0.52907765,-0.52662367,-0.5253982,-0.09345388,0.16149756,-0.7751016,-0.6605355,-0.17780483,0.42368835,-0.092556044,-0.19299424,0.58784324,-0.20738342,0.3455649,0.78963774,0.62804526,0.03950724,-0.21804824,-0.4987735,-0.9179308,-0.98983085,-0.35090026,-0.07236925,-0.34158418,0.31662405,0.65839607,0.30516854,0.30580232,-0.99962646,-0.48480663,-0.24307612,-0.8438966,-0.25047466,-0.2927057,-0.09622284,0.19690566,0.413906,-0.5108443,-0.12884754,-0.3988477,-0.40348393,0.41526103,-0.2286417,0.9993854,-0.67422664,-0.50356203,-0.3531675,0.07198456,0.42316228,-0.14176479,-0.36440194,0.7112834,0.5139634,-0.9782953,-0.6162336,-0.12756278,0.10711916,-0.93763757,-0.16858616,-0.12481185,0.028612792,0.057972047,-0.4424809,0.049568303,-0.03017301,0.2640687,-0.581721,0.99733996,-0.7212219,0.8074359,0.071842164,-0.117075495,-0.77061284,-0.57416964,-0.35733053,-0.5204358,-0.5768347,0.12588151,0.9939443,-0.121422455,-0.010079652,0.31311354,0.15016164,0.34317526,-0.98079485,0.20917763,0.7592574,-0.70055246,-0.77863735,-0.9999969,0.65704936,0.20455612,0.14915723,-0.31697875,0.011632966,0.16544321,-0.4057879,-0.47519585,-0.30545154,-0.6824373,0.5250946,-0.5658999,0.1456048,-0.86063766,-0.26595744,-0.48637772,0.3997183,-0.85053676,0.76628435,-0.89404887,-0.2851241,-0.013628785,-0.17918423,0.15519838,0.30190566,0.2235076,0.3468212,-0.37576884,0.33685023,-0.5044788,-0.22356683,0.24143504,0.059924643,0.37709567,-0.9315626,-0.6624455,0.18187068,0.38043654,0.38855755,0.10169496,-0.9989649,-0.6048023,-0.5397523,0.3108781,-0.036556747,0.28024593,0.6966201,-0.15235429,-0.738091,-0.2002626,0.30888125,0.2925393,-0.44303298,0.34128663,-0.22626902,0.3384394,0.22833568,0.21549805,-0.29467255,-0.38316396,-0.070875674,0.34830946,-0.50237596,-0.67419565,-0.5938883,0.493152,0.81683344,0.21552038,-0.9995098,-0.664301,-0.12008525,0.065271474,-0.83918446,0.20972937,0.6683805,0.4167744,-0.12065462,-0.8107863,-0.099422574,-0.35600957,-0.31141454,-0.102494225,-0.27496523,-0.9504591,0.41977426,-0.31017846,0.53226095,0.20657691,-0.6325123,-0.45984003,0.0681785,0.45367903,0.35764134,-0.4910594,-0.35364223,0.2896302,0.07904295,0.27415255,0.19187216,0.2577711,0.65007824,0.19719496,-0.6926076,0.0696913,-0.1413658,-0.5555217,-0.16396262,0.68157214,-0.47026542,0.28711578,-0.9740271,-0.24864815,-0.13831435,0.4882431,-0.35790738,-0.28403792,-0.016862703,-0.08458784,-0.46342802,-0.7308001,0.37308565,-0.10622396,-0.34553444,0.5768823,0.23292668,0.08763204,0.77399933,0.3774164,0.006924712,-0.5098338,0.8978959,0.6343785,-0.047873277,-0.891406,0.68290037,0.06517166,-0.3698014,-0.82446706,-0.7221124,0.28672165,0.9976413,-0.3274749,-0.41934285,0.13021174,-0.033238176,-0.69296175,0.25846353,-0.5760409,-0.27998525,-0.3238544,0.95869315,0.011582194,0.7610005,-0.31934887,-0.39323834,0.9999992,-0.7939626,-0.5729658,0.14700472,-0.3566515,0.04303567,-0.23353721,-0.018934056,-0.664514,0.6924301,-0.80852306,0.012630528,0.17569925,0.25233817,0.5228929,-0.040761054,0.10907209,0.036618285,-0.92519516,0.27893862,0.6651873,0.38616493,-0.9751057,0.15628879,-0.25890568,-0.053302445,0.68506664,-0.690193,0.37901664,0.2066903,-0.8459302,-0.8687406,-0.58968765,-0.29804406,0.09644856,-0.5852059,-0.3980124,0.057546254,-0.3435195,-0.63508207,-0.57086647,0.6102418,-0.4182738,0.52198625,-0.5548132,0.531437,-0.69563395,0.367594,-0.07341237,-0.05318461,-0.15710296,-0.36490002,0.2690298,-0.7463827,-0.9059537,-0.3477259,0.011105895,-0.3559779,-0.032230835,-0.28447175,0.34369725,0.99978405,-0.3766383,0.098954156,0.33296642,0.46828258,0.6206234,0.4856657,-0.5610992,0.45483562,0.124057226,0.19552837,-0.67267805,-0.09122006,0.04932655,-0.57204586,0.5335424,-0.12559655,-0.21505326,0.99777377,-0.456071,-0.4936173,-0.32932213,0.15745088,-0.5305944,-0.58585346,-0.4845951,0.050078593,-0.08752937,-0.11365671,-0.17787673,0.5067323,-0.33233482,0.27862722,-0.28103718,-0.6556602,0.23938476,0.5363152,0.1512363,-0.39332545,0.33091968,0.039654914,0.7353226,0.23331673,0.94042754,0.4387047,0.26622146,-0.50713503,0.4028754,-0.2430104,-0.3692481,0.9779566,0.13345142,-0.43566626,0.59568197,-0.03424182,-0.026104601,0.726041,0.20313764,0.30213657,0.99995154,-0.09863128,-0.9764766,0.5559019,0.9998994,-0.34328204,-0.41156545,-0.9981386,-0.74296635,-0.15946017,0.8266756,-0.01144374,-0.7115956,-0.14975712,-0.4763095,0.41060326,0.15232407,-0.37371,0.000334484,0.038878538,-0.5146411,-0.08542565,-0.99998975,0.99523133,-0.762452,0.17672662,-0.23199368,-0.086206675,-0.64807546,0.32972068,-0.93085957,-0.77129245,-0.7217852,0.10753693,-0.8456456,0.099380925,0.08465531,-0.15616901,0.68274194,-0.5010213,0.54235697,0.27583745,-0.9999442,0.31077385,0.41016054,0.006394941,-0.19383928,-0.7771178,0.38061577,0.08511092,0.48834062,-0.353675,-0.60148543,0.47711882,0.57533705,0.8908608,0.1346168,0.9006031,-0.27410692,-0.5569882,-0.31659874,0.5397082,0.12380443,-0.2934462,-0.70563823,0.18081892,-0.14110023,0.025704887,-0.3240787,0.5080693,-0.6784766,-0.30230072,0.05329143,0.05360769,-0.6790876,-0.1465469,0.04418629,0.9706249,0.31593785,0.030745393,-0.8266874,0.11727173,0.04934598,0.9996506,0.052955642,0.51939434,-0.18177864,-0.23721528,-0.57689387,0.15044266,-0.9868839,0.078913815,-0.19978748,0.16903737,0.68752253,-0.31906563],
    [176,1,"CCOP(=S)(OCC)Oc1nc(Cl)c(Cl)cc1Cl",0.9181262,-0.005342887,-0.6376574,-0.005651109,0.44988215,-0.15890422,-0.9640337,0.43447953,-0.6340033,-0.09470138,-0.15594499,0.08863017,-0.5691922,-0.50238436,0.68540484,-0.79634064,-0.49001214,0.25488964,-0.3232421,-0.65527344,0.36364505,0.24572933,-0.06378873,-0.3009153,-0.4786684,-0.20860519,-0.22408096,0.53696424,-0.27584848,-0.33249322,0.039890543,-0.30807918,-0.6210249,-0.33582193,0.67317075,-0.8020156,-0.10883124,-0.45668006,0.99282676,-0.8997688,-0.9714512,0.37526652,-0.07410115,0.46337974,-0.5311649,-0.83895123,-0.31188717,-0.15930377,0.9851605,0.04730741,0.23978113,0.2519789,0.38773337,0.045395356,-0.7377735,0.26036257,-0.63201636,0.23575525,0.31857783,0.27846462,0.75913745,0.6149003,0.081260905,-0.17329928,-0.8576022,0.7621567,0.22768798,-0.099535845,0.35944918,0.003296363,-0.6977823,-0.5743375,0.105743945,-0.14215964,-0.30413076,-0.94911206,0.07883829,-0.26197547,0.6770549,-0.99906844,0.45734257,-0.13003835,-0.9398552,0.09999397,0.65369093,-0.7930016,0.27853552,0.3394488,-0.11818336,-0.025901536,0.07016473,0.3575479,-0.030113945,-0.22216332,0.9987768,0.2702399,0.53752697,-0.28778523,0.03302561,-0.65182567,-0.1378101,-0.37195233,0.051357243,0.29285857,-0.8609215,-0.98221606,-0.18163137,0.5680397,0.98485583,0.70335555,0.2698795,-0.7140161,-0.5458298,-0.45936933,0.25865814,0.047910992,0.2630916,0.71551704,0.9981434,-0.42870745,-0.70591354,0.7217122,0.7111119,-0.12940751,-0.5667101,-0.12975009,-0.051114514,-0.3524278,0.011180108,0.99964833,0.20077372,-0.24449833,0.20124628,-0.66015667,0.25051013,-0.98719984,-0.38229454,-0.15268587,-0.5224907,-0.40992388,-0.9967924,-0.47851482,0.90868944,-0.059478175,-0.44971153,-0.7234829,-0.42104685,-0.1570519,0.09172713,0.052408084,0.67929894,-0.849647,-0.2126519,0.26821992,-0.7820691,0.08607652,0.11354574,0.9571445,-0.82172954,-0.96014655,-0.9152651,-0.85767514,0.07086833,0.24599944,-0.15708302,-0.06798352,-0.23204,0.25825426,-0.25292578,-0.05022191,0.32815772,-0.17655094,-0.3952211,-0.000424615,0.12017303,-0.53936917,-0.6553026,0.788542,-0.737446,0.8529583,0.9211316,-0.8954269,0.30692193,0.80121905,0.007908521,0.18442573,0.6710064,0.47673082,-0.47459185,-0.51036036,0.47417885,-0.10933611,0.001098312,0.44321287,-0.3789621,0.25435606,-0.54290843,-0.8291803,-0.01866666,0.8562409,-0.41626427,0.5501377,-0.7823522,-0.78497803,-0.38430884,-0.6674887,0.6065345,-0.73281527,0.23491634,-0.9994934,-0.040835656,0.21022761,-0.79095936,0.55655324,0.6678785,0.014764095,-0.70749724,0.14155586,0.3662434,0.07540876,-0.26937938,-0.77820927,0.22803989,0.40203914,-0.9908676,-0.4294183,0.5795629,0.07530315,0.62844884,0.6921993,-0.29693824,0.3381976,-0.3557786,-0.42173707,0.48073882,-0.11417593,0.46149963,0.3364857,0.5445382,-0.64559156,0.8699154,-0.19311675,-0.1863631,0.291896,0.40148294,-0.56503415,0.8463947,-0.76741517,0.15133227,0.19602415,0.49306688,-0.9982459,-0.39711276,0.6219471,-0.73817164,-0.3747217,0.37154093,0.012381997,-0.84964186,-0.1312313,0.17395969,0.02249873,0.3957605,-0.17645809,0.22744071,-0.42461845,-0.5130849,0.3758712,0.48300275,-0.12208669,0.864944,0.9984098,-0.636027,0.67984825,0.8207379,-0.63178957,-0.23027939,-0.5256958,0.39126468,0.055626266,0.07414631,0.99706835,-0.61004585,0.27939692,-0.6237217,-0.5552843,0.63807124,0.8969707,0.9168635,-0.7420114,-0.16162086,0.9948555,-0.34617215,0.8018224,0.23189397,-0.25828984,0.9973815,-0.977151,0.42062163,0.6492976,0.20760536,0.5647969,-0.5511678,0.25658715,0.29386604,0.6434844,0.50568813,0.8774758,-0.29783988,0.41302073,0.57685304,0.017022362,-0.3008096,-0.09364403,0.16860548,0.28230673,0.43721804,0.47778577,-0.99996084,0.38315856,-0.32472706,-0.39746156,0.25504893,-0.9433621,0.46115014,-0.7020038,0.22431758,-0.78102165,0.37546903,0.45801812,-0.000342108,-0.37213734,0.31000227,-0.26729217,-0.13484815,0.61080086,0.27744398,-0.4949347,0.25602695,0.52681124,-0.08964959,-0.8144385,-0.5970228,0.15775687,0.41520584,-0.11838759,-0.36875343,0.7502894,-0.16581015,-0.0679334,-0.96431065,-0.64376867,0.73227674,-0.6263628,-0.17639549,-0.10003727,0.28124416,0.9998317,0.05949721,0.32338005,0.37883613,0.30454588,0.5799922,-0.6208365,-0.6033924,-0.3741698,0.28285483,0.49087936,0.2862344,0.5039638,-0.029607255,0.8592328,0.2644407,-0.4085012,-0.20642525,1,0.70195866,-0.094872355,-0.03234783,0.25045076,-0.39219314,-0.38174233,-0.18413636,0.2762931,-0.1491081,-0.430649,-0.14591452,-0.12638594,-0.90048945,0.585149,-0.2443704,0.5124596,-0.7151562,-0.24890256,-0.14761783,-0.9146602,0.3542951,-0.46054044,0.38355723,-0.6735591,0.41629723,0.07833313,-0.20412917,0.6285812,0.3059251,-0.16940099,-0.06341402,0.51149625,0.38229468,0.23318659,-0.7280898,0.34503055,0.68730223,0.09778211,0.40588498,0.10553705,0.99999976,-0.7132181,-0.97668505,0.35069236,0.9996387,-0.35900158,-0.7913077,-0.9999534,-0.19027159,-0.68619406,0.30061606,-0.7017325,0.29117602,0.17184791,-0.38449302,-0.16480754,-0.30249667,0.6461878,-0.36038327,-0.13984443,0.09069542,0.31421766,-0.99996287,-0.99714565,-0.966981,0.42140502,0.6600282,-0.5123225,-0.010904796,-0.036100388,-0.66137546,0.046459258,0.51226795,0.7636958,-0.47802463,0.0003899,0.017566372,-0.04014073,0.7664073,-0.18209079,0.382763,-0.5105909,-0.9996842,-0.32667452,0.52267396,0.57601917,0.45771512,0.17801757,-0.84081626,0.656044,0.7045053,0.24374147,0.3912131,-0.7796263,0.3474972,0.915024,-0.46940893,0.11997495,-0.51179737,0.101840764,-0.19536494,0.21481654,-0.70087373,-0.4106022,-0.62856156,-0.013683426,-0.97839004,-0.48525277,-0.6478365,-0.018102353,-0.22271161,0.117703766,-0.09821767,0.7384713,-0.6379058,0.37994424,0.45634276,0.8592384,0.24047303,0.040485788,0.33958653,-0.022919599,-0.07983164,0.99995196,0.9263978,0.46186507,-0.3350732,0.46602124,-0.42579266,-0.29709488,-0.9647985,0.009319593,0.20866698,0.6061188,-0.45957655,-0.42652],
    [177,1,"CC(C)N(Cc1ccccc1)C(=O)C(C)(C)C",-0.8630272,-0.03253676,0.08734233,0.24121766,-0.019028556,-0.26290408,-0.52661,-0.30164623,0.31482944,-0.44156006,-0.75312203,-0.24157852,-0.23781037,0.27335414,0.2046528,-0.4887939,-0.37744012,-0.265289,-0.16502948,-0.17612258,0.2157741,-0.6534684,0.23314665,0.10195303,0.26250684,0.5990405,0.21718325,0.68486446,0.33205816,0.6007846,0.026967224,0.031433534,0.17701544,-0.50750995,-0.29639417,0.6620469,0.28021333,0.8382296,0.96465087,-0.67098224,-0.9980436,-0.32473773,0.097496554,-0.1351303,0.07828708,-0.9777488,0.19239888,-0.011426655,0.89396805,-0.1317298,0.044723637,-0.34211448,-0.66786706,-0.58450425,-0.6713437,0.36913148,-0.34190577,0.5444391,-0.21061076,-0.2024154,0.30729705,-0.123038456,0.56942296,-0.4879048,0.44375613,-0.06432461,0.32849032,0.16680698,-0.4172596,0.4721509,-0.11320663,-0.9433885,0.17161693,0.62000155,0.7833543,-0.5181232,0.17093281,-0.15062028,0.32916346,-0.99989015,0.00726228,0.06755189,-0.85578376,-0.5713517,0.47569478,-0.75013226,0.067785494,-0.08192976,-0.39895788,0.35593998,0.25659546,-0.33613533,-0.040962342,0.51341903,0.9389819,0.37045637,0.7459936,-0.16619112,0.39240712,-0.30142418,0.08501927,0.44490495,-0.2655385,0.6051787,-0.5689803,0.47123572,0.28402406,0.54200304,0.98929346,-0.38807037,0.32313812,-0.11187513,0.05035545,-0.5309461,-0.3954842,0.3937633,0.15679276,0.3894639,0.99838936,-0.70234656,0.30167168,-0.30007166,0.2047181,-0.069876745,-0.09965364,-0.084262036,0.11971589,-0.49611703,-0.061850514,0.9999051,-0.25409335,-0.25288403,0.4072594,-0.27618954,-0.06943422,-0.98442775,0.21356398,0.651582,-0.64543825,-0.7953616,-0.99227166,0.24091695,0.98606646,0.20542878,-0.34489486,0.30856282,0.39029843,-0.31487527,0.80106044,-0.09935546,-0.3882671,0.18956615,-0.05612554,0.74633676,-0.08605239,-0.4617175,-0.5134719,0.97766393,-0.7037909,-0.9012782,-0.96296245,0.33407152,-0.26478466,0.2045068,0.3254907,-0.031519927,0.6772064,0.62289786,-0.4308559,-0.22827192,-0.06697843,-0.3393081,0.1081552,0.30150947,-0.60717916,-0.9841043,-0.3874626,0.62013113,0.2084807,-0.3172653,0.10172526,-0.18635155,0.36139417,-0.11484603,-0.8173171,0.063156694,0.09772856,-0.43931615,0.016185746,-0.8100313,-0.78685606,-0.22371787,0.4365847,0.89878833,-0.41659918,-0.061035007,0.6322641,-0.9024545,0.52314085,0.014010387,0.15045793,-0.1454111,-0.32940438,-0.2674945,0.3154515,-0.3044377,0.45961073,-0.041040055,0.1446575,-0.9992974,-0.60263926,-0.36779636,0.37634873,-0.13451745,0.48519522,-0.052662946,0.020732446,-0.2915138,-0.45950374,-0.37121636,0.19094938,-0.45245254,-0.6566017,-0.64277804,-0.9448441,-0.35636538,0.38799793,-0.6504467,-0.24025388,0.39804637,1.82e-05,0.040801786,0.6617594,-0.3090878,-0.2655725,-0.39958143,-0.35734516,0.34919035,-0.5232313,-0.105736464,0.85185975,0.1699745,-0.1526477,-0.6607882,-0.17138141,-0.012910601,0.2435793,0.22565822,0.31783155,-0.11545862,0.68700564,-0.998694,-0.24630019,0.65709674,0.48755366,-0.117015734,-0.63916,-0.23126008,0.56649756,-0.17810228,-0.12724884,0.5812831,-0.6987313,-0.06062117,0.6287665,-0.07886531,0.23592144,0.58423305,0.64061165,0.42055684,-0.19998005,-0.0229425,0.23019084,0.33005017,0.12666732,-0.14753555,0.11353484,-0.789509,-0.8906365,-0.7656546,0.58994514,0.99962395,0.08784702,-0.51831824,-0.37139985,0.25981382,-0.07605632,0.90888983,0.9731915,-0.015563178,0.5072013,0.9967845,0.31680432,0.70537376,-0.34117863,-0.5094422,0.9968345,-0.990797,0.2854802,-0.22411129,-0.013485725,0.018177526,-0.2005512,-0.92228603,-0.778802,-0.12357836,0.6776069,-0.33667272,0.72728443,0.09147301,-0.34703776,-0.59818256,-0.23627305,0.17343356,0.7647132,-0.5357709,0.62915903,-0.1481715,-0.99998623,-0.313544,-0.29167324,0.708786,0.03307086,0.12278031,-0.37072155,0.12566537,0.39426914,-0.9686676,0.14496584,0.20027588,-0.14999202,-0.3428988,-0.03923487,-0.12968694,-0.33885458,0.48112634,-0.27770773,-0.4390651,-0.41402823,0.43227467,-0.04284362,-0.19064333,0.43261126,0.49043304,-0.027770264,-0.21893129,-0.13006036,-0.045733497,-0.41507256,0.14694406,-0.9943949,0.16578926,0.18578531,0.15641263,0.049275916,-0.49641863,0.38659754,0.9998223,-0.47476423,-0.51653975,-0.3266147,-0.5294707,-0.6095583,0.54598445,-0.87208384,0.13855425,0.16651964,-0.3942649,-0.34283262,-0.3238685,-0.25012264,-0.049426958,-0.40604976,0.76544327,0.033547595,1,-0.20779298,-0.54979223,-0.5893534,-0.3920953,-0.5267264,0.4885208,-0.48631576,0.36849254,0.24259245,0.2167452,0.4847802,0.38572046,0.6263705,0.09540273,-0.18191348,-0.19519238,0.5143606,0.11787217,-0.41854683,-0.6755545,-0.45079187,-0.43773434,0.51014733,-0.4557694,-0.85333246,0.015952183,0.32016996,0.42263994,-0.6113633,-0.37627465,-0.52613574,-0.7143662,-0.21677753,-0.15221044,0.64535964,0.041745696,-0.0974433,0.36325136,-0.36104155,0.61215526,1.0000001,0.40211254,-0.98376286,0.20490223,0.99987364,-0.6699852,-0.68982303,-0.99994326,-0.10286471,-0.09110435,-0.292773,-0.036529865,-0.27783707,0.5980532,0.10375705,-0.23345356,0.4925905,0.21384633,-0.26410374,-0.06566915,0.3729157,-0.50196487,-0.99998045,-0.9986899,-0.93368936,0.16393931,-0.43351227,-0.42149514,-0.21760426,-0.5272317,-0.8760836,0.35480663,-0.096731655,0.49915278,-0.2869131,-0.21321382,0.39912355,0.18328588,0.27866143,0.021019766,0.28827503,-0.79760784,-0.9999594,-0.025086096,-0.08513534,-0.61537623,-0.32165352,0.25007847,-0.99166405,0.177662,0.5423117,-0.20627873,-0.34628052,0.551153,0.24395102,0.8254202,-0.24829638,0.7823053,0.030596942,-0.0943844,-0.1532075,-0.46650875,0.3200208,0.59627664,0.3108251,-0.5656631,0.50402737,-0.2468938,0.023774806,-0.28922975,0.004966617,-0.27343246,-0.28833193,0.5422919,0.001508265,-0.36439088,0.09209329,0.7285832,0.05803715,0.50763345,-0.08587008,-0.09793287,0.19066508,0.999707,0.2718014,0.14005904,0.51017183,-0.56511873,0.24415368,-0.032523226,-0.9287755,-0.090072334,0.48689783,0.35961345,0.8283252,0.30673793],
    [178,1,"COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1",0.029457523,0.06619374,-0.086186014,-0.73190224,0.041124236,0.25632802,-0.018202169,-0.16730905,0.5709205,0.07043244,-0.44588023,-0.59464896,-0.29394138,-0.74806184,0.46871737,0.113657735,-0.43124002,0.20808695,0.30938533,-0.03241214,0.46146548,-0.2490198,0.20353255,0.083408125,0.4945277,0.2497096,0.34086543,-0.03513607,-0.10714094,-0.5130294,-0.4269857,-0.5221199,-0.2003273,0.36789945,-0.14455192,-0.836882,-0.38926417,0.6270197,0.99930567,-0.091537915,-0.79649913,-0.59795266,-0.45608968,-0.42228514,0.26840854,-0.1800551,-0.030104857,0.37015876,0.688118,0.7180981,-0.17376548,0.48302114,-0.25890973,0.77024215,-0.73254734,0.12519376,-0.37796387,-0.74732256,-0.18377477,-0.13122901,-0.50493425,0.6632001,-0.010265682,-0.10195856,-0.4616719,0.63181776,0.11705287,0.3220728,-0.2326246,0.5983968,-0.9265678,-0.8137162,0.15064575,-0.72306293,0.64129895,-0.06294141,0.10918691,0.104675665,-0.5823662,-0.9996633,-0.209408,0.15926743,-0.9135982,-0.13802719,0.24423072,-0.890476,0.28660157,0.62973964,-0.2132321,-0.23910448,0.20775379,-0.25545624,0.6758576,0.5482865,0.9987407,-0.07288964,0.26154217,-0.39018664,0.33297005,0.22250612,0.36285025,-0.13518615,-0.33082676,0.6288903,-0.9960869,-0.533754,0.036688726,0.12357397,-0.9142905,-0.002887665,-0.31967688,-0.17740944,-0.09624795,-0.018240463,0.5441438,0.53970927,0.19854285,0.34288114,0.9804968,-0.36733216,-0.16678748,0.14835055,-0.4737843,0.20428474,-0.41750485,0.53227663,0.7954776,0.15898204,0.0653833,0.9997267,-0.027085034,0.15580885,0.37466794,-0.10700088,-0.40434876,-0.97929305,0.6253759,-0.41833037,-0.65266985,-0.54835635,-0.99999803,-0.2609032,0.55593735,0.68062705,-0.37284893,-0.001000798,-0.28378463,0.3219813,-0.92164475,-0.1407982,0.48581025,-0.6676995,0.6257095,0.21261041,0.12769216,0.57400686,0.06158985,-0.47565317,-0.8463036,-0.61580384,-0.6443574,0.20680593,0.05210926,-0.042097267,-0.49266747,-0.16396977,-0.3477041,-0.57117873,0.4171859,0.424065,-0.31746483,-0.3378442,-0.23820707,0.30607545,0.011022526,-0.8588667,-0.40421352,-0.53448385,-0.09396835,0.5569875,-0.079040825,-0.9671061,0.6487992,0.633801,0.2349022,-0.42691404,0.73995304,0.232252,0.4507793,-0.49791464,-0.17552495,-0.48588735,0.55054873,0.4735,-0.52092785,0.29713398,0.05143839,-0.528069,-0.010274541,0.3094363,0.45516273,0.25654224,-0.5087783,0.5948016,0.14861056,0.2871214,0.14958832,0.284712,-0.3443436,-0.99987066,-0.091816336,0.53859186,-0.29011747,0.43399817,-0.3518369,-0.6297223,0.47494268,0.29831403,-0.38466325,0.3277606,-0.3029541,-0.42799103,-0.598351,-0.61589676,0.9921374,0.38956687,-0.15497945,0.21899411,0.575487,-0.36842686,0.5651997,-0.41831788,0.3544641,0.21388692,-0.16364405,-0.5126397,-0.6407894,-0.57913595,-0.37092498,-0.03770905,0.9322884,0.2158742,0.6220822,-0.3859381,0.35204542,-0.02158346,-0.42937663,-0.19709529,-0.09486484,0.035386246,0.4980849,-0.7936528,-0.3169044,-0.44030425,-0.223524,-0.50592947,0.4209131,0.42312834,-0.0344677,0.28103384,-0.50131404,0.61608785,0.41825658,0.16329037,-0.124284424,0.004188029,-0.18561512,0.6740098,0.9304492,0.51187414,0.597855,0.87788624,0.4565241,0.33930477,0.4192288,-0.46872693,-0.04249865,0.2563017,-0.7554459,-0.18109685,0.4512312,0.99485236,-0.36677054,-0.043382544,0.14509496,0.24150719,-0.27870125,0.53083843,0.37013474,-0.20328632,-0.06371947,0.7569821,-0.2464581,0.84682155,0.064283445,-0.1477152,0.9999988,-0.9771761,0.2618207,0.60429776,-0.7309249,-0.3694053,-0.6446947,0.3403795,-0.194207,-0.7554182,-0.97638863,-0.24063905,0.31075606,0.4523226,-0.62320065,-0.24544035,0.51368487,0.27012995,-0.45116115,-0.25289553,-0.21190849,0.4119219,-0.9571132,0.09438518,0.009516436,0.7480201,0.17063025,-0.45606261,-0.33799493,-0.22931328,-0.024758259,-0.96586585,0.32895634,0.4104176,0.5984943,0.6931387,-0.04382969,-0.794175,0.41067794,0.6009968,-0.47720113,-0.5873711,-0.49871674,0.3560356,0.5009229,0.07667916,0.4656576,-0.29110718,-0.38724414,0.2746932,-0.5233891,-0.22836132,-0.1853093,-0.94711673,-0.8969353,-0.20456994,-0.88552475,0.5507928,-0.20659801,-0.49424323,0.08176185,0.9996985,-0.25685006,-0.07446305,-0.21846396,0.50654465,-0.81980914,0.72651875,-0.8994068,-0.35229015,0.41495702,0.23997554,0.46070448,-0.13440375,0.051129647,0.26750463,0.44815853,-0.17536953,0.6723649,-0.9809809,-0.22492681,-0.004465972,-0.1570913,-0.21322478,-0.35200828,-0.09468923,-0.3100287,0.11369231,-0.5556883,0.24027617,0.28244916,-0.07978033,-0.037156895,0.78512627,0.56240964,0.29424232,-0.6882303,0.2407049,0.2888589,-0.12981981,0.35003346,-0.47234175,0.53500897,0.4206311,0.6206479,0.21444668,-0.017383998,0.34678477,-0.34450185,-0.2679345,0.27343756,-0.37929934,-0.6488717,-0.27627602,0.008520224,0.017513791,0.32183045,-0.5694128,-0.30231592,0.56770986,0.99991065,0.2451012,-0.9722516,0.21589652,0.9995613,-0.25411552,-0.13473171,-0.99849916,-0.82622886,-0.33087632,0.19625938,-0.48519668,-0.034370087,-0.073981665,0.079639085,-0.23802663,-0.30859983,-0.32347423,-0.116597354,-0.034063876,-0.317908,-0.008022201,-0.99997866,0.9999994,-0.062029276,-0.3338127,0.23475032,-0.42263222,0.6738681,-0.2333129,-0.84881073,-0.061446913,-0.18827097,0.11177674,-0.6356616,0.33424488,-0.5159745,0.230703,-0.36331078,0.14691812,-0.06850051,0.8276172,-0.9997949,-0.49085268,-0.80677164,-0.091449514,0.20421667,0.032600544,-0.7936404,0.51239467,-0.4477207,0.48610926,-0.21758953,0.22334936,-0.29698378,0.98774225,-0.19150825,0.84553576,-0.59750235,-0.5387068,-0.19849959,-0.37013206,0.36860862,0.3518436,0.48769796,-0.05040087,-0.04193773,0.5615371,0.08359605,-0.45783117,-0.19979204,-0.19517636,-0.050445046,0.6963315,-0.007185841,-0.17799062,0.02350166,0.99694157,-0.22713934,-0.5637579,0.33204287,0.20279182,0.49308217,0.99993634,0.6150797,0.0334749,-0.2649012,-0.019924032,0.1369051,0.07371702,-0.9930307,-0.42456403,0.5957198,0.7650896,0.8105975,0.34838095],
    [179,1,"Oc1cc(Cl)c(Cl)cc1Cl",-0.7179588,-0.3762852,0.056157086,0.63192004,-0.35809126,-0.055963177,-0.37132305,0.10306196,-0.14547941,-0.45233947,-0.80666053,-0.12892802,-0.04060734,-0.59651774,0.34631184,-0.4954863,-0.4093985,-0.008219896,0.086376935,0.026931036,0.38494074,-0.7839564,0.6867313,0.54878783,0.16859914,0.09602634,0.22906768,0.10879207,0.5917161,-0.46181637,-0.18720849,0.8197203,-0.050902553,0.12911937,-0.45811123,-0.08409531,0.048091926,0.47970656,-0.3715662,-0.9581201,-0.99466556,-0.048187017,-0.09158383,-0.3448395,0.67517555,-0.99646056,0.4529527,-0.27182457,0.96255857,-0.0636349,0.005975246,0.3876295,-0.20247447,-0.039812684,-0.96157277,-0.1405515,-0.7777121,0.9516813,0.14595512,0.589039,0.25719756,0.19502634,0.41013902,0.35240445,0.14680801,0.7039072,0.5193257,0.64818805,-0.2169813,-0.057791874,0.59182495,-0.89590466,0.23910196,-0.12718582,0.8008828,-0.35117364,0.38913885,-0.24130383,-0.016509393,-0.9902257,-0.82199484,0.02431457,-0.8038932,-0.10920082,0.36636838,-0.015360836,0.42625314,0.08885978,-0.55155385,-0.37998256,0.3897197,0.26278812,0.16156438,0.23338576,-0.008455271,0.0452548,0.45496368,0.12794042,0.45395306,-0.35896385,0.73567784,-0.5430209,0.6742063,-0.853222,0.97193336,-0.033854492,0.11647202,0.24988669,-0.91366386,0.63850725,-0.6396908,-0.5329546,-0.19170332,-0.22460048,0.34321007,0.48073635,0.7921275,0.3292736,0.99912,-0.5052493,-0.23199344,0.06695127,-0.17561425,-0.20878607,-0.35969964,-0.1732975,0.26651356,0.28979012,-0.49308583,0.99959457,-0.06733765,-0.48978257,0.51125944,-0.41275236,-0.04473139,-0.41439015,0.67487025,0.31240705,-0.6982978,-0.13521415,-0.9977418,0.25174993,0.99658763,0.5543866,0.29997095,-0.46837518,0.35465926,-0.3439259,0.99643373,-0.6028581,-0.19752651,-0.2761079,-0.3491212,0.06151939,-0.39932904,-0.27281645,-0.26917845,0.99935365,-0.62489736,-0.5002504,-0.9899485,-0.2765201,0.053716037,-0.041667804,0.6421914,0.42289764,0.10612149,-0.45625758,-0.21501759,-0.01930117,-0.82551855,-0.25967887,-0.018760452,-0.45780802,0.41409844,-0.96850723,-0.9065599,0.20782882,-0.32816076,0.6373488,0.54783297,0.6791258,-0.37305033,0.20481004,-0.92327803,-0.45621735,0.5382498,0.5324484,-0.21835865,-0.3360474,0.85244334,0.35604924,-0.16708866,0.3727359,-0.2741714,-0.5240478,0.66765034,-0.35435143,0.18780786,0.6920889,-0.7442837,0.31238362,-0.80664575,-0.5402017,0.20513283,-0.511941,0.6305452,0.39419758,0.20150271,-0.65377986,-0.108638495,0.063679405,0.30001244,-0.21193391,-0.23912738,-0.2689385,0.096960135,-0.034706693,-0.45753038,0.04059231,-0.41990578,-0.4573495,-0.35614577,-0.079243034,0.9936848,-0.25794485,-0.04426878,0.7585335,0.21319237,-0.1647689,-0.44929427,-0.5279543,0.48247406,-0.73786986,0.012546505,-0.608248,-0.074666016,0.35958856,-0.5697365,0.10192949,0.9354245,0.3870999,0.15552804,-0.6897246,0.7273428,-0.31455368,0.5838446,-0.10362885,-0.29235035,-0.59595734,-0.3223291,-0.9981449,-0.40660962,0.3096514,-0.54170144,-0.33550227,0.61426145,0.12953164,-0.24131024,0.24956876,-0.47119325,0.54005045,0.6324627,-0.6433674,0.63782054,-0.3896549,-0.1951383,0.0158556,-0.576197,0.52952254,0.1560034,-0.7163188,0.2515847,0.31971285,0.10865667,0.9147753,-0.2671966,0.042108245,0.25533393,0.10316261,0.37000173,0.999073,0.3327363,0.8540852,-0.28964716,-0.32336226,-0.27117398,-0.118329294,0.5209888,-0.052716598,-0.44982123,0.99942887,-0.13301861,0.81439245,-0.063602835,0.08549995,0.997962,-0.9680178,0.3735492,0.45283243,0.28646407,-0.046039883,-0.001057759,0.33948386,0.19204065,-0.45769098,0.99897116,0.74485534,-0.68405825,-0.3685535,0.42770803,-0.50426126,0.54745454,-0.021190759,0.9383109,-0.6481839,-0.03905926,0.019844586,-0.9456256,0.09421377,0.014896779,0.42270917,0.40528405,-0.67831784,-0.6373983,-0.299854,0.35964292,-0.98083514,0.5303484,0.09305886,-0.25057206,-0.44676456,0.00389768,-0.13306917,0.46508238,0.6801189,-0.111953184,0.097561516,-0.24308483,0.40499565,0.290352,-0.78420085,-0.24608538,-0.20794535,0.10453228,0.42814687,-0.32847577,-0.33336055,0.019212302,0.94698066,-0.99630564,-0.28710556,-0.15858555,-0.56796104,0.29153106,0.56141865,0.06091788,0.9866006,-0.10955646,-0.31139892,0.16237696,0.16923964,0.5286242,0.25431284,-0.8611328,-0.5069674,0.7699234,-0.22885151,-0.028111545,0.113199055,-0.066407375,0.6657175,0.67767537,0.9553126,0.1674322,1,0.4105145,-0.46285072,0.13498808,-0.27435642,-0.94370097,-0.019168232,-0.3679681,-0.59255534,-0.65337443,-0.46403867,-0.13144812,0.086852334,-0.49281076,0.859226,0.078451484,0.52841115,-0.55417126,0.4043932,0.108135864,-0.15122288,-0.167446,0.3634173,0.8788096,-0.03482475,-0.9743509,0.02675355,-0.4380802,0.17949706,-0.06513887,-0.22397566,-0.48629203,-0.04644239,-0.29807195,0.05446994,0.65472555,0.7238661,0.40697786,0.123805314,0.69992274,0.2677844,0.9998145,-0.07381452,-0.99682796,0.34539187,0.9986782,-0.6592183,-0.45190775,-0.99654174,-0.27035135,0.8214153,0.67431676,-0.3461453,-0.34981334,-0.29208118,-0.054476347,-0.25003582,-0.11606762,-0.35569423,-0.43087485,-0.2380122,0.5261211,0.038688067,-0.99994624,-0.9996079,-0.99704707,-0.35432902,0.18450177,-0.28122386,0.32980415,-0.68149185,-0.8941243,0.54393566,-0.1652561,0.06470513,-0.8916628,-0.13908456,0.10977361,0.055356476,0.09329754,-0.003581903,-0.274673,-0.9921273,-0.99985063,-0.30347338,0.2711783,0.29588136,0.54285806,0.41342872,-0.99533683,-0.13763082,-0.58771086,-0.5869085,0.29055336,-0.27888265,-0.13434461,0.9347142,0.4522019,0.81759524,-0.49121535,0.7598706,-0.5547684,-0.6867644,-0.6314068,0.30524874,-0.65935844,-0.2625293,0.35726997,-0.15019329,-0.612321,0.21036145,0.1113283,-0.15566891,0.034761734,0.7484028,-0.51609355,0.34676757,-0.07991627,-0.945787,-0.10980242,0.1534884,-0.26809508,0.20100856,0.5051649,0.9989259,0.6801816,-0.615328,0.14618723,0.36222664,0.39553192,0.0422671,0.86715376,-0.22814694,0.5020593,0.72677046,0.60887843,-0.2913779],
    [180,1,"CCC(CC)Nc1c([N+](=O)[O-])cc(C)c(C)c1[N+](=O)[O-]",-0.37196773,0.4291351,-0.36104223,-0.33337474,0.36798486,-0.7757744,-0.35532686,0.49591768,0.35007524,0.35823005,-0.78474057,0.19668606,0.19482388,0.49271336,-0.5222666,-0.8499943,0.7530705,-0.059779156,0.091333605,0.38002083,0.51465774,0.22539599,0.80187124,0.7952991,-0.7266322,-0.03653921,-0.26875898,-0.1606198,-0.12412712,-0.7741752,-0.43410096,0.4388464,-0.72023547,0.3803444,0.13901865,-0.43423277,0.37097886,0.3465781,0.9953544,-0.2545831,-0.9695522,-0.32426727,-0.28313097,-0.060359757,-0.3755933,-0.8401137,0.05137132,-0.022671951,0.55786467,0.63428783,0.31537205,-0.026509132,-0.65059716,0.085765764,-0.7033976,0.059485074,-0.68576217,-0.4145019,-0.15093103,0.60422117,-0.054093126,0.21794464,0.22097807,-0.7778456,0.16584592,0.53537804,0.45121762,0.3983538,-0.16453826,-0.08111025,-0.86291313,-0.93220395,0.29554597,-0.6025348,-0.6653126,-0.7671847,-0.47176164,0.18268119,0.39488456,-0.9997366,0.8986708,-0.8209866,-0.9256749,0.22467805,0.47798863,-0.5983499,0.11443791,-0.049858462,-0.5046126,0.40728503,-0.060269404,0.5014937,-0.22230202,-0.43780926,0.99964976,-0.5912586,0.29128298,-0.147957,-0.096107416,-0.48683628,0.20554729,-0.43164667,0.2575661,-0.6928671,-0.95077884,-0.83334976,0.002459055,0.11220718,-0.82384455,-0.29215917,-0.013629156,-0.110007405,-0.3570372,-0.5515223,0.15407895,0.073906355,0.0818882,-0.3712953,0.9982631,-0.1328873,0.38817492,0.05129147,-0.30384898,-0.64390445,-0.6271464,0.2089828,0.6256292,0.2306738,0.83126366,0.9993718,0.42981422,0.4251612,-0.14729322,0.2060826,-0.56181496,-0.9783761,0.800928,0.47545323,-0.89497906,0.54036087,-0.99771553,0.5170614,0.5006451,-0.73545635,-0.64927846,-0.16077964,-0.5035126,0.31219494,-0.04688912,0.14771691,-0.50810903,0.84608316,-0.51968324,0.25879,-0.48390004,0.10749801,-0.42054382,0.70304,-0.9557498,0.8255091,-0.91197354,-0.1805659,0.07350126,0.30551785,0.30366382,0.780258,0.06342228,-0.61685747,-0.43753043,0.267451,0.025526859,-0.26046315,-0.24691314,0.07659185,0.38356504,-0.5398573,-0.85540843,-0.30418625,-0.49747673,0.45149148,0.43649936,-0.9978391,-0.71394724,-0.2808623,0.42693108,-0.20559746,-0.6244135,-0.18792765,-0.4221873,-0.6658212,0.43703452,0.50383013,-0.09366368,-0.35894087,-0.54380393,-0.090503216,-0.17118894,0.94443995,-0.18920915,0.5169291,0.000684385,0.27963307,0.6913693,-0.21811524,-0.7054913,-0.71018636,0.013285635,0.24947739,-0.192108,-0.9989296,0.33263242,0.09625951,0.1627855,0.058997385,0.58129305,0.39745218,0.55973375,-0.1189521,-0.35217148,-0.74412745,-0.055494096,-0.60792816,-0.15129551,0.7358141,-0.97132146,0.37971112,-0.6222648,0.3766247,0.5944021,-0.9257525,0.46918985,0.16054054,0.52044404,0.11013555,-0.7427141,0.55178064,0.18618055,-0.21594156,-0.5205573,0.07451324,0.4858788,0.6045377,-0.09437287,-0.32370397,-0.18351169,-0.27708128,-0.61947984,0.011472832,0.25385758,0.20831837,-0.59865236,-0.9982618,0.453698,0.280523,-0.09121577,-0.42191115,-0.15893349,-0.74469334,0.13280468,0.35680997,-0.68078303,0.06028922,-0.60713917,0.45479387,0.8298336,0.4114705,-0.34931275,0.06843959,-0.025488261,0.12563922,0.24522562,0.9394522,0.37983733,0.15579955,-0.4722205,-0.71055824,-0.63900095,0.07374574,0.005380619,-0.43878573,0.64946145,0.99778366,-0.101335384,-0.52012473,-0.034817148,0.37466985,-0.42492312,0.37447828,-0.11006808,-0.32617202,-0.28099266,0.9750538,-0.09956661,0.96653116,0.089379385,-0.4804025,0.99882877,-0.96582794,-0.5552565,-0.31610832,0.74441075,0.8494035,-0.76423365,0.22234817,-0.45447555,-0.31836736,-0.43167403,0.33135858,-0.50312454,0.157855,0.33131662,-0.1902739,0.7650434,0.10946409,-0.94601566,-0.003655134,0.27186486,0.19914342,-0.98642707,0.2575416,-0.3199205,0.29383495,0.28938377,-0.84871304,-0.39315346,-0.6769205,0.5189485,-0.8702843,0.14846371,0.28044668,0.27423844,-0.19107962,-0.21296984,-0.16661637,-0.47508407,-0.2196332,-0.0841645,0.67252195,-0.14570136,0.7610119,-0.6258313,0.66666716,-0.61869264,-0.52604026,0.12496754,-0.25413397,0.33428487,-0.47726312,0.5208436,-0.39042264,-0.93691623,-0.07227656,-0.17934512,0.23348306,0.36782405,0.04670784,-0.06711169,0.99975556,0.157867,0.12745522,0.65910774,0.0901592,-0.11108872,-0.03745635,-0.63693213,0.4680043,0.18481416,0.44561344,-0.22174412,-0.29765257,-0.6908653,0.28649622,0.4874429,-0.1191131,0.07818088,1,-0.24594375,-0.7077192,-0.75623244,0.26178837,-0.322531,0.50576043,-0.6335022,-0.5633433,0.6956705,-0.101919524,-0.2942862,-0.49250975,-0.70853937,0.75966674,-0.14783993,-0.33788985,-0.27691254,-0.19386236,0.5103313,-0.9403889,0.6832408,-0.82700443,0.64558095,0.19277559,0.8574278,0.046350107,0.5463565,-0.2195494,-0.20882642,-0.034133688,0.5473712,0.99774957,-0.37926692,0.3437258,0.73445374,0.63277197,-0.38153535,0.7154228,0.41259983,0.288351,0.999966,-0.4492134,-0.9646262,0.110135235,0.9998248,-0.45096672,-0.8141174,-0.9996117,-0.53026426,0.41214004,0.7824888,0.2730785,-0.48003367,0.16923842,-0.28580728,-0.58957505,-0.11265199,-0.6105318,-0.5582304,-0.059762303,0.52312905,0.1843567,-0.9999314,-0.99824333,-0.91617143,0.6825355,0.7933608,0.06757198,-0.8287287,-0.2452549,-0.8115633,-0.68479705,0.67456436,0.5194134,-0.8920599,0.6391933,-0.37375316,0.43309206,-0.38291535,-0.32442147,-0.31764573,0.09793063,-0.99994874,-0.17095497,-0.2957307,-0.5594218,-0.28504154,0.5543265,0.010606419,0.75629586,0.5504811,-0.8680575,-0.29307666,0.04232493,0.7481438,0.9509872,0.31243187,0.23253487,-0.21560477,0.013906477,0.38696215,0.49900225,0.27736133,-0.04178036,-0.25729004,0.22500621,0.5793759,0.51119214,-0.5983643,0.5216386,-0.29106,-0.58401096,-0.3627331,0.72217125,-0.64124316,0.027272705,0.09633661,0.94606054,-0.48090458,0.11061805,-0.7958693,0.6651333,-0.82897085,0.9994785,0.38531438,0.27120087,-0.34424904,0.70653355,-0.8206829,-0.3281349,-0.96645945,-0.32896906,-0.54712594,0.16496189,0.728751,0.28394353],
    [181,1,"CCC(C)(C)c1ccc(O)c(C(C)(C)CC)c1",-0.6104231,-0.20393747,-0.01808514,-0.22058813,0.40785608,-0.07551165,-0.4872444,-0.51294506,0.23772031,-0.52331865,-0.9398037,0.5681877,0.4946292,0.2059281,-0.07021529,-0.79134506,-0.2857073,-0.46421093,0.49965918,-0.30740607,-0.3228631,-0.371982,0.62760216,-0.5688181,0.0676091,0.68389094,0.27063802,0.4405395,0.8039406,-0.23093677,-0.55106425,0.59412795,0.13920179,0.22303027,-0.21309108,0.64834857,0.23132677,0.26406798,0.9757909,-0.7631214,-0.97711444,-0.23519003,-0.32218248,-0.20465384,0.1422742,-0.9554954,-0.2130915,0.45417473,0.9776065,0.33884025,0.8090049,0.2276223,-0.30946758,-0.32297117,-0.9577427,-0.2340886,-0.72709334,0.4002173,0.26600373,-0.2159922,-0.30267167,-0.54562956,0.2552392,0.26285523,-0.025056273,0.4123904,-0.0807551,0.42436883,0.18538432,0.6724231,0.4743453,0.042622577,-0.10325666,0.2452014,0.9001264,-0.34537375,0.15628262,0.061705958,0.22181621,-0.99729264,-0.58558834,0.4314885,-0.7949925,-0.053498074,0.4508669,-0.9356918,-0.60920376,-0.3229009,0.12589315,0.19705571,0.27951714,0.12496063,0.06968873,-0.8028967,0.37156087,-0.46366885,0.8491492,0.44428545,-0.055708576,-0.073283456,-0.17969134,0.40505683,-0.032014746,-0.4526527,-0.7718833,0.63640994,0.010337575,0.002648295,-0.9186155,-0.7141743,-0.086134374,-0.25647753,-0.18207742,-0.49702466,-0.24730296,0.53000903,0.35826427,0.054434694,0.9984816,-0.16179436,0.6205545,-0.28872597,-0.15402183,-0.057733096,-0.20866826,-0.3069139,-0.13432296,-0.32001993,-0.114138335,0.9999739,-0.4653201,0.34742895,-0.21117678,-0.33692235,-0.1358137,-0.8062017,0.28212714,0.82613724,-0.86750716,-0.59107393,-0.99933094,0.5714099,0.9944586,0.32270277,-0.5047324,-0.10782706,0.20072617,-0.24690908,0.5728543,-0.5011773,0.099659555,-0.92434245,0.63704574,0.566059,-0.36731926,0.036958136,-0.69261795,0.9356114,-0.90954936,-0.50553906,-0.96614635,-0.17808922,-0.19967467,0.24567854,0.49048835,0.17661785,0.8582332,-0.017867303,-0.41109154,0.004673011,-0.8250661,-0.40091294,0.44720957,0.35560903,-0.19399464,-0.97908384,-0.73953295,0.34227815,-0.4868277,0.29824507,0.045352343,0.67874306,-0.4826776,0.23374777,-0.17601377,-0.5964135,-0.05688422,-0.19763552,0.4245503,-0.6003136,0.1879897,0.41828346,0.21031779,0.7314052,0.062110644,-0.61038357,0.32445285,-0.71763456,0.4214929,-0.2586576,-0.4342809,-0.001213975,0.8809946,-0.23543732,0.3355953,-0.4791836,0.21937346,-0.3224573,-0.0539278,-0.99882543,-0.029484235,-0.23534915,0.6128563,-0.09698747,0.5233001,0.29209435,0.1454074,0.07380328,-0.5037593,0.05957956,0.21048687,-0.20006688,-0.3437353,-0.51288414,0.98106617,0.35196468,-0.032381687,0.046692062,-0.06876222,-0.26875108,-0.36607802,0.15990485,0.3457934,-0.00856108,-0.049672794,-0.13517632,0.042508177,-0.24482094,-0.6833332,0.071450934,0.919112,0.91852903,0.13577937,-0.4795591,-0.4441818,0.082881354,-0.5510077,0.03579494,-0.6661515,0.110214666,-0.16811548,-0.99830145,-0.60805225,0.82359564,0.40959466,-0.6754812,-0.675702,-0.029593345,-0.10454411,0.23228474,-0.6281373,0.6017942,-0.55253327,-0.7290115,0.8671302,-0.46924564,0.21381727,0.61204803,-0.19019757,0.19595909,-0.74125737,0.9505469,0.2397256,0.3129546,-0.4859126,-0.825007,0.018952051,-0.41267964,0.14238234,-0.6695695,0.73341185,0.9991944,0.68902016,-0.3753583,-0.343266,0.16847685,-0.061249666,0.7582271,0.5672081,-0.26348186,0.35211375,0.9938777,0.19277687,0.9305417,0.015334694,-0.46854886,0.9991084,-0.9988417,0.27398092,0.003528837,0.17031242,-0.2837439,-0.48705527,-0.17792325,-0.3671953,-0.9543905,0.4386904,0.39934188,-0.286225,0.4648372,0.22355464,-0.42819235,0.031682443,-0.16226454,0.91178995,-0.6184789,-0.40804866,-0.43853003,-0.9430022,0.7623906,0.10348087,-0.25883624,0.7563267,-0.59272814,-0.27574795,-0.7180777,0.470453,-0.98058367,-0.27925077,0.3736527,0.35832882,-0.2878905,-0.12998615,-0.37161916,-0.23209758,0.9492877,0.5378871,0.15297174,0.57364565,-0.04659188,-0.58014774,0.10599952,0.5156473,-0.25766194,-0.15474088,-0.51183593,-0.6705013,-0.42553496,-0.156733,0.2453746,-0.9835547,-0.092424594,-0.66086155,-0.4457187,0.7110408,-0.43237922,0.121086635,0.9998311,-0.12920891,-0.7139748,0.5842112,0.31454435,-0.55831355,0.43449035,-0.9227026,-0.15480806,0.4755078,0.30242822,0.22688186,0.5314806,0.6115288,0.19787505,0.549796,0.67750055,0.40232575,1,0.46072564,-0.65460765,0.10552944,0.29708216,-0.754006,0.24149473,-0.53651494,-0.4240573,-0.001808112,-0.27887625,-0.028695345,0.7667537,0.22151259,0.74543136,0.0400657,0.18654333,0.33264688,0.2923272,0.48275334,-0.91098976,-0.763487,-0.8125289,0.8155838,-0.46809632,-0.95982033,0.72647434,-0.035380542,0.04667054,0.6546488,-0.2756354,0.009811536,-0.72831494,-0.7811791,-0.15400465,0.15755296,0.31570816,-0.5241915,0.18381119,0.16227277,0.0760955,0.99986243,0.2784378,-0.98846203,-0.027649155,0.99985206,-0.5571129,-0.23944414,-0.9986312,-0.42121384,0.57288367,0.5792794,-0.34715056,-0.6017727,0.39726722,-0.112348415,-0.9177554,-0.7270827,-0.21442738,-0.45390528,-0.30439332,0.23701866,0.035218168,-0.9999713,-0.99639934,-0.95538414,0.045750488,-0.02861508,-0.042698808,0.31386968,-0.7289801,-0.6694347,0.024919111,-0.4915005,-0.2442844,-0.7128279,-0.48826006,0.43233806,0.26303428,0.7634037,-0.08756696,-0.2170826,-0.66975415,-0.9999486,-0.539927,0.25307575,0.33098575,0.3559409,-0.030918004,-0.9967997,0.63122934,-0.5423576,-0.3101815,-0.25922143,0.65934056,-0.20483199,0.96622676,-0.36580548,-0.19754684,0.49677762,0.3522167,-0.32852322,-0.71294475,0.11495979,0.3391097,-0.6375917,-0.73800594,-0.6091824,-0.27663863,-0.17967358,-0.6778885,0.31506997,-0.3584579,0.005935947,0.62410504,0.20678332,-0.6085351,0.1419012,0.82675356,0.1279266,0.12539215,0.26900667,0.16951913,0.25501648,0.99968,0.54078776,0.2761466,0.020335674,0.47710857,-0.1147158,-0.24151394,-0.9557227,-0.44053447,0.2431272,0.66272104,0.6610579,-0.49580574],
    [182,1,"Fc1ccccc1C(F)COC1CCC(N=c2[nH]cnc3[nH]ncc23)CC1",-0.07396027,-0.040584207,-0.001648465,-0.08221379,-0.29596144,-0.21816635,0.28980643,-0.047585975,-0.55873686,0.14212129,-0.32444632,-0.4561251,0.2207616,0.021943435,-0.31694928,-0.32745007,-0.3736287,0.1566253,0.030611243,-0.12515691,-0.10998599,-0.61251485,-0.70850414,-0.05004561,0.34380805,0.2786985,-0.14032951,-0.5392743,0.46651298,-0.2567428,-0.6086417,0.4701192,-0.6222235,-0.57829005,0.43567514,0.44638202,0.93572044,-0.4149653,0.9990115,-0.5850019,0.85696286,-0.49652398,0.50645655,-0.015471742,0.40675104,0.4416975,-0.34930876,-0.18549667,0.67010576,-0.8341836,0.3190698,0.13757618,0.33412725,0.31144813,-0.20734909,-0.44016045,-0.2686276,-0.28406867,0.44146216,0.01569083,0.63209957,-0.30105725,-0.07051658,0.21407728,-0.8086876,0.1629552,-0.5340161,-0.6578367,0.30114293,0.23986599,-0.9894442,-0.8544836,-0.23387642,-0.121912174,-0.09690493,-0.3453079,-0.25860938,-0.12856968,0.39878216,-0.99911034,-0.576379,0.63228774,-0.92335755,-0.46835485,-0.5960943,-0.8832709,0.03440651,-0.61484957,-0.63457924,0.6828854,0.82030606,0.80861235,0.43142372,-0.5913329,0.9985628,0.08346199,0.078401744,0.27195367,0.46100938,-0.158036,0.17363188,0.30056915,0.30765188,0.99602485,-0.99870294,-0.73057926,-0.7603174,0.8303426,-0.9998831,-0.066536,0.5373284,0.27124807,0.32281402,0.18022417,-0.093536556,0.25999948,0.7871565,0.75070095,0.9121302,0.2191802,0.050367955,0.6840772,0.1651179,0.05086694,-0.16050443,-0.2317706,-0.5364696,0.16848084,0.2922407,0.9996959,0.42776456,-0.061256845,-0.50085986,-0.42199835,-0.18005554,-0.9628763,0.06513546,0.19418076,-0.20501493,-0.29881343,-0.99999976,0.12165441,0.53860265,-0.22494213,0.14376615,0.53839636,0.32157537,0.44341776,-0.99512976,0.8323993,-0.3100325,0.046848055,0.56705004,0.32169992,0.07403627,-0.24468431,0.05507533,-0.80741704,0.27466607,-0.058086667,-0.31837484,-0.4123011,-0.00524874,-0.41631955,0.44331557,-0.7547459,-0.22432965,0.12075036,0.13677993,0.3425037,0.76094294,-0.23437792,-0.060436223,-0.12610579,0.56394726,0.62373275,0.78528905,0.83132356,0.3455283,-0.01945911,0.09310668,-0.62875366,-0.6911144,0.4827527,0.56051034,0.77582955,0.43511054,0.05773159,-0.3572086,0.4962482,0.07579059,0.17895994,-0.27798906,-0.12633857,-0.3333085,0.64140105,0.47812298,0.21390533,0.35674426,-0.58128345,0.6056722,0.13461964,-0.7826815,0.24863733,-0.07515874,-0.37089092,0.16558251,-0.7395481,-0.09905197,-0.99985784,0.17299066,0.7304323,0.064522624,0.3916963,-0.28177822,-0.32481793,0.15513122,-0.23227564,0.4084471,0.5999361,0.70046425,0.92754245,0.061501823,0.23952456,-0.9563143,-0.06942462,0.4338313,-0.22267155,-0.087732635,0.30760276,0.19824801,0.005452992,-0.375726,0.5259052,0.098763674,-0.26536226,-0.039797157,-0.2327393,0.6731015,0.31399864,-0.9963248,-0.49954745,0.2512421,0.79808694,-0.4209389,0.2176835,-0.61518687,0.22679761,-0.6927181,0.031546716,0.6443135,0.051244803,-0.19441386,0.660505,-0.0812222,0.25799605,0.7699884,-0.37311155,-0.18994172,-0.19114184,0.12386959,0.22823621,0.28710887,-0.2683212,-0.017858036,-0.23042849,-0.5021128,0.013898407,0.6435681,-0.11306035,-0.66268206,0.99994415,0.73564625,0.2797411,0.447641,0.81811446,0.50089496,-0.67593294,-0.27603292,0.26052555,-0.59553415,0.9895295,0.34823698,0.7321028,-0.59509903,0.78787816,-0.3222876,-0.19855526,-0.8761637,0.676697,-0.33695987,0.4946886,-0.7048183,-0.88530177,-0.6813669,0.3351603,0.9999997,-0.98534334,0.88329583,0.50101435,-0.2208936,-0.83408153,-0.51279294,0.001550457,0.8510372,-0.12974948,-0.9951797,-0.13294433,0.8113339,0.6998683,-0.005228598,0.008326062,-0.18780333,0.23952849,0.67820287,0.41862217,0.56196415,0.68231636,0.98042685,-0.13365747,-0.2499413,0.46464318,0.48914906,-0.28068808,-0.96456194,0.17924376,0.33600765,-0.48186305,-0.8998489,-0.28902096,0.14091785,0.18387422,-0.8230738,0.37084815,-0.25109038,0.6539054,0.1800287,0.34368733,-0.3833648,-0.7273493,-0.113295004,-0.67307097,-0.22640254,-0.48657346,0.6330518,0.1511268,0.19097069,-0.56077135,-0.13785864,-0.9198917,-0.7977484,-0.059816737,-0.25937855,-0.34117377,0.1552082,0.50966865,-0.405656,0.99879164,0.22088419,-0.48614916,-0.16733983,0.15245298,0.198665,-0.76848996,-0.5859863,0.25835896,-0.4191159,-0.15217179,-0.21637589,0.535963,-0.5155561,-0.5592786,-0.7832716,-0.78454864,0.10469978,-0.9999999,-0.19241291,-0.3507935,0.13426606,-0.1340898,0.322443,-0.5003706,0.06780495,-0.14044671,-0.2806451,0.17736155,-0.06236721,-0.30079657,0.27116862,-0.77291244,-0.33321187,0.04851134,-0.4104696,0.6556294,0.8398904,0.29128376,0.14076084,-0.07872483,-0.8112867,0.20201541,0.8382589,0.089994386,-0.8162836,-0.3549328,0.7136257,-0.55867,0.75820816,-0.6780198,0.3542181,0.64153904,0.47038066,-0.74290717,-0.4650464,-0.6059015,0.22305764,-0.19201952,0.874644,0.15307966,-0.9875032,-0.24855483,0.99555916,-0.49530768,0.07394602,-0.97469485,0.48062697,-0.88450706,-0.72381216,-0.43297586,0.06033309,0.17665702,0.7957922,-0.6680722,-0.15620336,-0.73057395,0.77847785,0.6332733,0.38957867,-0.55408716,-0.9999472,1,0.5463878,0.5445116,-0.73643506,-0.9370152,0.028554913,-0.76866686,0.81352246,-0.30437285,0.24933842,-0.58066964,0.23919925,0.18350445,-0.33680138,-0.11956991,-0.0757176,0.38822028,-0.12160969,0.8971517,-0.9989551,0.17952271,-0.003108327,-0.08733583,-0.6036968,-0.15190664,-0.6287229,-0.12638265,0.2009298,-0.23112585,-0.5536634,-0.022467963,-0.77825874,0.95085496,0.72180754,0.64915,0.55724746,0.16178496,0.33477953,-0.38187867,-0.6429231,-0.44168866,-0.33713716,0.25513375,-0.9764449,-0.68030506,0.30548912,0.04114223,0.17292216,-0.44748262,-0.06429354,-0.3702797,0.09522083,0.68983775,-0.39031208,0.9992568,0.115560405,-0.44645905,0.6260897,0.44199833,0.19162303,0.99985075,0.79178154,-0.7409696,0.6659785,-0.46069512,-0.23330691,0.41989583,-0.99892086,0.6301494,-0.14038436,-0.8948204,-0.70202404,-0.44693774],
    [183,1,"O=c1[nH]c2ccc([S+]([O-])CCN3CCC(Cc4ccc(F)cc4)CC3)cc2o1",0.06803009,-0.20043659,0.21785055,0.03628589,0.052120652,0.05359564,-0.1925744,0.28535414,-0.072871804,0.4709549,-0.6471308,0.5482911,-0.14106332,0.30041286,0.36342093,-0.24227096,-0.5130445,0.2078111,0.10522399,-0.33310005,-0.24603963,-0.04609726,-0.17728394,0.031660836,0.7311909,-0.14300121,0.12609506,0.7292257,0.6841279,-0.7260395,-0.7594556,-0.2362776,0.13873616,0.34660456,-0.49093878,0.19910957,-0.3477146,0.19434425,0.9992786,-0.41559094,-0.042773355,0.8491427,0.037233315,0.38996038,0.24247758,0.39923206,0.9203273,0.59602326,0.6632138,0.10792305,0.5606189,-0.2618226,0.6550887,0.12520497,0.26283878,-0.82500446,0.25509673,-0.79506713,-0.41456893,0.5238696,0.006211203,-0.5165983,0.6371828,0.74728185,0.001914694,-0.6525574,0.10307961,0.46221337,-0.42676854,0.45683435,-0.98106813,-0.875434,0.088135704,-0.34364644,0.7142088,0.29728684,-0.16172165,0.16086237,0.83210605,-0.99924695,0.16326518,-0.7751093,-0.97151315,-0.45905083,0.16948572,-0.875223,-0.2547872,-0.5852689,-0.582605,-0.46487117,0.8448824,0.31730285,-0.27642626,-0.8430796,0.99902064,0.7917086,-0.04597556,0.847282,-0.52208894,0.46865666,-0.6022436,-0.6641,-0.19449265,0.99735373,-0.9980605,-0.62587714,-0.12652409,-0.61142254,-0.99650615,-0.7804315,-0.52310705,0.76877636,-0.17774084,0.1221022,0.3239356,-0.5539445,0.18832926,-0.4473589,0.89062893,0.5858461,-0.01065299,-0.093116194,-0.12324834,-0.69579726,-0.37339213,0.27416462,-0.0704054,-0.8258304,0.2959246,0.99957836,-0.15236694,-0.1834536,0.4258976,0.075614646,0.7730482,-0.9542457,-0.50862855,0.25459045,-0.002434755,-0.88326466,-0.9999997,0.23751271,0.2258989,-0.3949127,0.7952025,-0.19285455,-0.2288023,-0.3274762,-0.9935704,-0.25119767,-0.009336307,0.2422036,0.4700556,0.47388068,0.47453967,-0.35445365,0.3069404,-0.83657867,0.635398,-0.16739254,-0.12673695,-0.17288962,0.5440497,-0.14260788,-0.56081545,0.35026693,-0.8334153,-0.049386624,0.19664654,0.7080852,0.2605248,0.079728454,0.6594561,-0.06719443,0.22863927,-0.22018692,0.77371854,0.03779086,0.52276856,-0.5665776,0.28689402,-0.9058522,0.18705493,0.39798403,0.5058441,-0.72351635,0.5659344,0.21296322,0.40900198,0.63908195,-0.54856694,-0.2926083,0.052618872,0.029551094,-0.47909248,-0.3803927,0.017103175,0.29489464,0.50694954,0.40646493,0.44738725,-0.21925713,-0.14853759,0.8232341,0.6335429,-0.6119874,-0.83981496,-0.65116036,-0.6398058,-0.99981344,-0.19772433,0.059328157,0.026977908,0.25238103,0.7025256,0.15133722,0.8534177,-0.09737143,-0.103944995,-0.103238724,-0.44516027,-0.09365529,-0.4303544,0.87533385,-0.4697886,-0.8430985,-0.76331675,0.3071361,-0.23367365,-0.4523952,0.21615659,-0.29448798,-0.5597587,0.05836268,0.11598405,0.14367661,-0.24571772,0.36153805,0.34564605,0.21013264,-0.992876,0.45922756,0.6933082,0.14570196,-0.26608494,0.33411664,0.19599482,-0.09213922,0.080635436,-0.6659322,0.42765373,-0.002581129,-0.8491333,0.5319619,0.89368594,0.6872265,-0.26799718,0.26169273,0.19283113,0.25897175,0.8063002,0.68608606,0.43874615,-0.24385354,0.7280933,-0.3233707,-0.16220316,-0.2175158,0.8568201,-0.14708275,-0.38704434,0.9999166,0.8142238,0.18545312,-0.6994945,0.8075719,0.4766678,-0.35647526,-0.33492717,0.19796224,-0.5753148,0.98461276,-0.21356449,0.03327619,-0.003943936,-0.16519825,0.076945946,0.7556795,-0.6249643,0.21306834,-0.40224707,0.3015882,0.58813864,-0.9042764,-0.21887715,0.6294446,0.9999999,-0.9660958,0.3100277,-0.17813128,-0.22892179,0.094137885,-0.3091607,0.42624694,0.7074302,-0.7606177,-0.99724287,0.37333995,0.9395007,-0.19923328,-0.16242334,0.32444993,0.44572502,-0.21323994,0.14131045,0.3079636,0.48031178,0.5838172,-0.87175137,-0.61178005,-0.3675539,-0.5045345,0.44038072,-0.29538268,-0.034009,-0.061526854,0.3413105,-0.71867955,-0.6165644,-0.056322895,0.04256432,0.1894235,-0.6455208,0.23461547,-0.14285865,0.2583769,-0.42410567,0.14205085,-0.59393275,0.076427616,-0.4933352,0.30660602,-0.3643497,-0.26829484,0.4033098,-0.19495025,0.44195896,0.025578685,0.006333358,-0.9343998,-0.69152397,0.16536842,-0.33650804,-0.3962666,0.4551043,0.14047389,-0.08835383,0.9980216,-0.69194084,0.2883364,0.18908337,0.600579,0.48337418,0.18396905,-0.76530737,-0.50318915,-0.48890316,-0.2879094,0.4729954,0.73554295,-0.22892988,0.6773222,-0.72431946,-0.4717746,-0.1089579,-0.9999993,0.6193943,-0.18448184,0.88089246,-0.28599474,0.44227117,-0.16162223,0.49880835,-0.32714394,0.5365225,0.19809432,0.03695159,-0.49929363,-0.13920939,-0.7723001,0.102331795,-0.6798552,-0.5195058,-0.20878853,0.7846264,0.47063598,0.71559733,-0.42125654,-0.79752415,-0.15832943,0.8829133,0.3799356,0.31909087,-0.3197406,0.0230085,-0.002070216,0.4355411,0.7703312,0.12493451,0.44183448,0.73543185,-0.64422214,0.11551317,0.18763338,-0.22156885,-0.015165494,0.9998228,0.83324677,-0.96197724,0.45064047,0.9985466,-0.62440914,-0.50241876,-0.99910015,-0.5853471,-0.887099,-0.85629714,-0.34366974,-0.34509137,0.20008081,-0.10426359,-0.04898947,0.56886744,-0.05532444,0.53298396,0.06128625,-0.471112,0.36156675,-0.99995214,1,0.7694557,0.25104794,-0.7413444,-0.13017406,-0.7508024,-0.001952888,0.8008452,0.2510486,0.51038986,-0.6211941,-0.66882855,0.064975135,-0.00815378,0.37440813,0.036814768,0.12692395,0.84880054,0.9432706,-0.99912935,0.028114822,-0.08085333,0.5074165,-0.22857775,0.2949561,-0.5772496,0.17341429,0.26910883,-0.3950875,-0.45833996,-0.5632051,-0.68495333,0.96605533,-0.08669119,0.7523398,-0.1515101,0.46015376,0.11846834,0.023382384,-0.87054235,0.13383809,0.036288917,-0.58219177,-0.9757323,0.22378457,0.032823056,0.1245407,0.15175435,-0.31486684,0.32887286,-0.18288518,-0.65686256,-0.11725789,0.5974255,0.9992144,-0.06848196,-0.7660616,0.016434548,0.8070247,0.13843948,0.9998782,-0.5203028,0.27495813,0.5425175,-0.3026857,-0.33967754,0.45086282,-0.9983972,-0.28461593,0.307422,-0.23704372,0.19216035,-0.29523537],
    [184,0,"OC(c1ccc(Cl)cc1)(c1cncnc1)c1ccccc1Cl",-0.8425882,-0.73586476,0.5563589,-0.46638864,0.32920545,-0.62722224,-0.86999214,-0.51450425,0.4723308,-0.51603496,-0.6812783,0.13523181,-0.03805182,-0.74177974,0.13539244,0.37196365,-0.1086486,0.3328746,-0.5101058,0.31370744,0.43567422,-0.15544319,0.1182827,-0.5260133,0.09863977,0.6351692,0.46633917,0.41130573,0.70254433,-0.46412617,0.30817243,-0.42307436,-0.01698182,0.6566446,0.4687508,-0.3026291,0.42295644,0.28216678,0.9974246,-0.892798,-0.5325488,0.5605087,-0.33262917,-0.11216976,0.21152624,-0.7937359,-0.06985971,0.2715177,0.5673724,0.12153181,0.40812758,-0.12806182,-0.28623083,-0.32782245,-0.9137685,0.4741146,-0.8329445,-0.16251153,-0.09642657,0.38212863,0.40478265,0.45519927,0.6960914,0.24295306,-0.056962524,0.6417498,0.1855834,0.6822616,0.19808768,0.06340938,-0.84049284,-0.8406471,0.53383887,-0.18274131,0.70551586,-0.6828779,0.47565988,-0.4998237,0.16263019,-0.9955659,0.12576672,0.020253725,-0.8033721,-0.024940575,-0.42550933,-0.88876873,-0.1258489,-0.5408824,-0.7239312,0.7655526,0.6862594,-0.507812,0.071830645,-0.24520537,0.98662645,0.049058747,0.79518044,-0.4809049,0.17809796,-0.23409104,0.55371696,-0.43208468,0.21646294,0.9037655,-0.9780252,-0.6866082,-0.55244654,0.45658314,-0.8478826,-0.054346647,0.12943187,0.4756613,-0.6069023,-0.2952153,-0.32011047,0.49909994,0.1541257,-0.11213834,0.9949806,-0.3295069,-0.41145563,-0.01619019,-0.3461069,0.50829077,-0.20916207,-0.38447198,-0.4068863,-0.09827149,-0.83716166,0.99979854,0.005775864,0.32888737,0.5065052,0.005567634,0.041353386,-0.8901236,0.7206987,0.68085706,-0.3732628,-0.5130073,-0.99999195,-0.58285356,0.9467243,-0.02066145,0.5535473,0.009989443,0.5245957,0.027679307,-0.48468253,-0.1206521,-0.21141632,-0.7233949,-0.5208713,0.4923492,-0.2079578,0.08044072,0.13818069,0.6403653,-0.7630591,-0.07152598,-0.8915715,-0.10108294,-0.3228311,-0.73145247,0.3774743,0.44394952,-0.31225923,0.68689334,-0.21011874,-0.40955508,0.061895445,0.25235024,-0.42214894,0.012787971,0.38637108,-0.8296553,-0.6496142,0.018926889,-0.2762136,0.7929007,-0.3588269,-0.17006426,0.22422194,-0.04636605,0.13339435,0.38134173,0.39847243,-0.16759159,-0.09124281,-0.26543224,0.29798877,-0.5774353,-0.36823905,0.35033983,-0.100220084,0.13413264,0.5584178,-0.45257944,0.64386183,0.47185388,-0.20028828,-0.24237163,-0.48818484,-0.057715043,0.047536913,0.6297568,0.3136607,0.029803637,-0.055228803,-0.99981,-0.45275128,0.72823614,-0.17085712,0.10576311,-0.22748844,-0.34765854,-0.3363866,0.004513325,0.22715215,0.512913,0.16494039,0.037386153,0.21616128,-0.15174827,0.9869339,-0.32432985,-0.18500203,0.13133515,0.35719648,0.6745509,-0.18417573,-0.38351116,0.57712615,-0.6926492,0.19719565,-0.5801495,0.003323444,-0.77273273,-0.2744006,0.18682237,0.87964433,0.093004584,0.007524363,-0.47066924,0.9143179,-0.2908976,-0.17168738,0.30281833,-0.34750083,0.12210348,-0.19289808,-0.7842917,-0.14400792,0.08495115,0.072116144,-0.5209249,0.5880367,0.27451032,0.59628874,0.26144823,-0.19675346,-0.10181599,-0.29433286,-0.6426453,0.3728272,-0.05378263,-0.24198322,0.20561846,-0.067357235,0.14809196,-0.5428107,0.9463401,-0.5888292,0.18394484,0.31539705,0.9320882,0.08303533,-0.76742715,0.23058526,-0.31586793,0.36900815,0.9982848,-0.23411468,0.329266,0.15459566,0.66442174,-0.5547129,0.68383336,-0.03537878,-0.66908556,-0.10519524,0.9703684,0.022485647,0.4319762,0.12155497,-0.6601321,0.9999989,-0.9928611,0.6686528,-0.53340286,0.029417453,-0.11804457,-0.61124057,0.092232086,0.75494015,-0.74822015,-0.8119678,0.19194393,0.509141,0.380647,-0.018635964,-0.55843574,-0.08380431,-0.023325924,0.6650734,-0.4377787,-0.19827247,-0.20484649,-0.93184507,0.016483426,-0.8845139,0.6789449,0.08714074,-0.75977176,-0.7037891,-0.38880128,0.7283836,-0.88018864,-0.253858,0.3436378,-0.352611,0.025959035,-0.009810953,-0.783578,0.4318555,0.66845465,-0.10459447,0.48480484,-0.46542868,0.61341935,-0.56779337,-0.7218254,0.18716134,0.48000312,0.2956364,-0.3527968,-0.585068,0.30703676,-0.83796114,-0.5060075,-0.969359,0.017960798,-0.003367958,-0.29497847,0.5325522,0.63904124,-0.12339619,0.99950063,0.22653958,-0.2980873,-0.06140987,-0.24850866,-0.023971558,0.4824907,-0.7944788,0.17993812,0.3640243,-0.19334553,0.22698005,0.088617496,-0.06423164,0.084535256,0.62422776,0.08046005,0.10261701,-0.9902611,0.21039166,-0.2532547,0.11838165,0.5823924,-0.13326259,0.06839025,-0.62279314,-0.6225397,-0.3748273,-0.016417919,0.29356417,0.19085318,-0.007330286,0.5998455,0.4055049,0.67907387,-0.053151324,0.10432071,-0.030461656,0.007911881,-0.8311178,-0.5849976,0.85218954,-0.44636524,-0.37479267,0.5281949,0.05114946,0.14998968,0.43506047,-0.72110635,-0.7584003,-0.098337516,-0.41339278,0.55008644,0.40395665,0.834169,0.20237295,0.51807904,0.2840742,-0.08978581,0.99990827,-0.24564983,-0.99264777,0.025138674,0.99676365,-0.85221934,0.12816317,-0.9972758,0.56870246,0.38311476,0.5906699,0.001078885,-0.6359041,0.172133,-0.45203573,-0.31723583,-0.6354912,0.46733508,-0.5567065,-0.25017795,0.065739006,-0.40259656,-0.9999847,0.99999964,-0.6724575,-0.35565388,0.058076944,-0.35933986,0.7113242,-0.6150742,-0.8200293,0.4484763,0.048639186,0.13083692,-0.6994323,0.501409,-0.5772104,-0.6015911,0.13325235,0.18150936,-0.6458851,0.28677365,-0.99988574,0.48022583,-0.40027788,-0.5031122,0.263449,-0.23030952,-0.96592975,-0.14685176,-0.808069,0.1189828,0.08386612,-0.2689577,-0.37632772,0.97959715,0.1688174,0.7244922,-0.30634928,0.20300665,0.019364858,-0.4991012,-0.33405933,-0.35270622,-0.011466025,-0.4061567,-0.21124057,-0.26246357,-0.18593776,-0.23049918,0.40919223,-0.019673152,-0.12144876,0.6560648,-0.4033141,-0.43019834,0.36976668,0.9855122,-0.24203967,-0.2983974,0.26695475,0.5531129,0.16946435,0.995601,0.8646374,-0.37545547,0.117394,0.17232752,0.17308661,0.16453083,-0.981034,-0.3743969,0.39761132,0.27505907,0.10789619,0.22446884],
    [185,0,"CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1",0.69532186,-0.5205391,0.4949364,0.20944837,-0.6195179,-0.71707565,0.3032435,0.24197252,0.6085407,-0.8008387,-0.32630903,-0.63758296,-0.06910122,-0.21753906,0.059162535,-0.58875823,0.14355786,0.51813596,0.77670634,0.30461085,0.80331063,0.60775745,0.35740027,-0.3842454,-0.06509505,0.084078744,0.21670692,-0.571045,0.23788394,0.6275107,0.3987394,-0.1384361,-0.36383146,-0.27501097,0.7204756,-0.1553539,0.11623441,0.41720796,0.99974906,-0.7490019,-0.25068352,-0.21826269,-0.17574151,0.2332981,-0.34392795,0.810211,-0.3278212,-0.6368824,0.99819267,-0.58680755,0.4917495,0.403451,0.04919394,0.6713865,-0.6226285,-0.051171098,-0.58284664,-0.8776069,0.3584424,0.7439661,0.6355694,-0.021363325,0.315671,0.16820583,-0.1503938,0.42674083,0.742612,0.15822665,-0.7955929,-0.10778266,-0.20788161,0.55074024,-0.51499104,0.21405938,0.7823599,-0.62377506,0.37817454,-0.5268849,-0.8760972,-0.9994876,0.21346268,-0.70878243,-0.7672914,-0.09847515,0.14241125,-0.9766184,-0.3663416,0.27106416,-0.27516434,0.033438016,0.16208833,0.72363657,0.73083633,0.08883424,0.99624455,0.100945584,0.75549084,-0.1076722,0.38620895,-0.5575255,0.5997522,-0.71544486,0.23079036,0.9731015,-0.9996753,-0.05514587,0.34109926,0.4960416,0.96219516,-0.6853586,-0.61465335,0.18571772,0.24301468,0.7336752,-0.20570579,0.12213029,-0.67152566,0.01174391,0.81955403,-0.30807534,-0.078960724,0.31967163,0.32137698,0.44898567,-0.7140432,-0.65044165,0.04686984,0.1832221,-0.0899355,0.999981,0.4610089,-0.55605876,0.50841373,0.550725,-0.12942573,-0.9901489,0.099236414,-0.6539857,-0.1583361,-0.48678064,-0.99999917,0.6888572,0.6733548,-0.20212781,-0.2542625,-0.20398656,-0.07226937,-0.011600645,-0.9985675,-0.25436583,0.628024,-0.69634616,0.8774749,0.3397948,-0.036505356,-0.5592095,0.20475549,-0.91315764,-0.9382014,-0.946805,0.36300725,-0.056239013,0.11598168,0.5968187,0.743609,-0.8791198,-0.04099725,-0.18841793,0.09104567,0.19426978,0.7192714,-0.33123505,0.2707843,-0.7085511,0.37731752,-0.8877172,-0.6371668,0.18396656,0.47128838,0.090802066,0.04091691,-0.8123908,-0.57010734,0.33723426,0.83593833,-0.37318283,0.5706584,0.4733012,-0.25850728,-0.1671774,-0.7296624,0.03514687,0.7436619,-0.21381997,-0.36773664,0.21630865,-0.392027,-0.25605476,0.5095719,0.3051061,0.43547678,-0.12665583,0.29913276,-0.18078616,-0.47595206,-0.22034445,-0.5081069,-0.4073767,0.89728236,-0.9999628,-0.678211,0.58020043,-0.36070147,-0.68346405,0.029240513,0.2306882,-0.53627896,0.23574957,0.22461648,-0.220448,0.7606768,0.04928307,-0.69168043,-0.7585311,-0.9770716,0.6819201,0.22909649,0.42005566,0.8103329,0.32984647,0.48705155,0.42265847,-0.37813002,0.6985018,0.31486484,-0.41662756,0.42236266,0.45849097,0.23234126,-0.32532188,0.8898812,0.858359,0.15367652,-0.6665854,0.109432206,-0.7725896,0.6315661,0.082647935,-0.39915687,-0.41916382,0.49088046,-0.68735194,0.4102496,0.3370542,0.3555788,-0.5292575,-0.3808206,-0.19876389,0.4284442,0.24216776,-0.46724057,0.4967414,0.25304618,-0.5246586,0.25750366,0.018284993,0.1412016,0.06341429,0.9721123,0.31972474,-0.2430723,0.9998836,0.028949672,-0.26992947,0.28810924,0.77488554,0.3654438,-0.85636914,-0.28807345,-0.60058665,0.017698035,0.96719533,-0.06531285,0.13524552,0.31816304,0.12518045,0.22410627,0.96313834,0.48250246,-0.3246141,-0.46362075,-0.009925888,0.37635356,-0.33889282,-0.10776937,-0.83898735,0.99999976,-0.99651515,-0.17405729,0.82249165,-0.21385789,-0.20691739,-0.46739814,-0.2979821,-0.42037207,-0.4912399,-0.9976313,0.5661655,0.8375119,0.1994636,-0.068561554,-0.71861905,-0.24295862,-0.51110464,0.58258945,-0.59244597,-0.5165253,0.4082498,-0.99987125,0.4885609,-0.000769093,0.19327855,-0.38918868,-0.89272445,0.048876047,-0.5882545,0.014877213,-0.91060007,0.7257687,0.7844759,-0.4578764,-0.5168496,-0.65365183,0.6259435,-0.07013432,0.9496594,-0.016864171,-0.6112177,-0.5386937,0.16106233,0.026956722,-0.75163203,-0.08367088,0.47841126,-0.005647244,0.016755806,-0.7692242,-0.31334344,0.044730533,-0.9818034,-0.4399363,0.4130779,0.1518803,0.6628297,-0.2608197,0.21964994,0.7063602,0.9998738,0.43787378,0.008609161,-0.17637016,-0.41974646,0.28932375,-0.14556806,-0.9712331,0.2662552,0.057731602,-0.013282357,-0.18588436,-0.2164661,0.13832662,-0.34967035,-0.1337444,-0.2670456,-0.11983453,-0.99822956,-0.40639853,-0.2506828,0.37377077,-0.36145,-0.3773525,-0.6540978,-0.23693484,-0.51413614,-0.107582755,-0.6387489,-0.36252087,0.5723239,-0.5263442,-0.43406066,0.5047525,0.23483503,-0.507989,0.44056568,0.25553173,-0.5401458,-0.67592055,-0.2690123,-0.41855195,-0.7912469,0.6248528,0.74228513,0.4751194,0.20262729,0.15204038,0.38416225,-0.21086381,0.44970253,0.357312,-0.80584,0.23780645,-0.53841114,-0.31315082,-0.23554786,0.08689971,-0.13407913,0.9999995,0.50884426,-0.943586,-0.117186986,0.9975747,-0.35351124,-0.26880345,-0.9999242,-0.0779015,-0.7782298,0.20039506,0.5823612,-0.2659083,-0.36691976,-0.24229245,-0.94327396,-0.3242687,0.70202416,0.6639594,-0.09550007,0.76928914,-0.39155692,-0.9998745,1,0.6648602,-0.11348551,0.43845236,-0.17454585,0.023299478,-0.27348068,-0.421524,-0.7100507,-0.5231202,0.13331634,-0.8432773,0.34767917,-0.53423953,0.5194937,0.23456006,0.009631488,-0.63985026,0.97263235,-0.9978825,0.16109285,0.33413398,-0.68659014,-0.14161274,0.65901,-0.8416867,0.010417323,0.51560473,0.213792,-0.5658488,0.06286801,0.8642207,0.91627175,0.24028796,0.16162108,0.22707364,-0.1001284,-0.073992744,-0.17157102,0.15981026,0.08417565,-0.66806513,-0.65404177,-0.9928469,-0.18805939,0.5559553,-0.24604467,-0.31704104,0.5294471,-0.88117933,0.12559311,0.77470064,-0.6116321,-0.5407328,0.99957734,0.02754354,-0.7865901,-0.11833384,0.11178829,0.25684395,0.99991566,-0.12557207,-0.4117034,-0.27139375,-0.2748687,0.033540256,-0.26737356,-0.9989895,-0.04307474,0.638823,-0.27324396,0.29634616,-0.08701794],
    [186,1,"CCC(C)(NC(=O)c1cc(Cl)c(C)c(Cl)c1)C(=O)CCl",-0.15476367,0.3670677,-0.48504204,0.08024206,0.30158547,-0.30918717,0.10302071,0.013593854,0.40537128,-0.30595213,-0.7975691,0.37856162,-0.090653,-0.546239,0.029374124,-0.88853985,-0.116933286,-0.25223055,0.28541416,0.2609716,0.53772116,-0.1573065,0.5641126,-0.33374915,-0.49164802,0.09683915,-0.029536856,0.290968,0.51643085,-0.37928095,-0.040971473,0.3057078,0.37195686,-0.5462203,0.15433373,-0.1913029,-0.41264787,-0.32284707,0.9964397,-0.2507465,-0.748082,-0.29018366,-0.37906384,-0.45335177,0.33519542,-0.8579975,-0.25216317,0.19006959,0.98660076,0.31630492,-0.02004368,0.5757378,0.5097448,-0.12248488,-0.827523,0.09119998,-0.49650586,-0.24448532,0.20356706,-0.20846985,0.58339614,-0.7578773,0.3085067,0.110813595,0.3493582,0.7613938,0.09193459,0.44141248,0.67126817,0.35601383,-0.79518443,-0.9008093,-0.13865858,0.040519085,0.60329777,-0.53294885,0.3558427,0.025602246,-0.22538623,-0.99985397,-0.6632953,-0.030861389,-0.92545915,0.54271215,0.43211704,-0.80759364,0.17289232,0.48608965,-0.18000315,-0.118284985,0.22638011,-0.14796403,0.22939822,-0.3504172,0.99509186,0.04894854,0.3919612,0.24766159,0.07331946,-0.5968897,0.31083187,0.5654722,0.42947093,0.5845291,-0.95344347,-0.21354862,0.32313678,-0.24503863,-0.9631618,-0.2974513,-0.18282357,-0.25323394,-0.3068483,-0.32861152,-0.19747786,0.201797,0.29997826,-0.20188569,0.9972477,0.08669986,0.05009706,0.23867418,-0.28937182,-0.3887127,-0.12005534,-0.26889822,0.37589568,0.082034044,0.14795715,0.9997154,0.20155708,0.06832444,0.627123,0.054878753,0.4993617,-0.98211306,0.51765126,-0.48558295,-0.8186907,0.46031433,-0.9957513,0.26174122,0.90463066,-0.029812472,-0.7478526,-0.5232058,0.259476,0.09286143,-0.24239467,-0.4368598,-0.29454088,0.39186773,0.11031045,-0.3264457,-0.76409954,0.6006552,-0.7042431,0.8069373,-0.91889495,0.2582949,-0.90548277,0.6486488,-0.17503077,0.14465451,0.8831235,0.045407537,0.69638616,-0.7605826,-0.16103779,0.2121285,-0.50043267,-0.15169242,-0.21691346,0.23674162,-0.45422795,-0.9297452,-0.61038345,-0.11111922,0.55411196,0.6541515,-0.26279178,-0.8112138,-0.017825188,0.13984689,0.46267217,-0.320686,-0.23950978,-0.38368422,0.73924375,-0.63215387,-0.3456878,-0.6636025,0.04322837,-0.45459628,0.1428892,-0.6764574,-0.2217562,-0.84229124,0.007598496,-0.42814615,-0.6253968,-0.5190258,0.6441129,-0.76069725,0.015669672,-0.6314231,0.51926637,0.48588312,-0.693751,-0.99984676,0.001922763,-0.49582216,0.46458334,-0.5646637,-0.12661672,0.3084603,0.007797005,0.14719377,-0.48934445,0.059916962,0.08279527,-0.5599455,-0.44439507,-0.2074203,-0.92529565,-0.17845389,-0.27562186,-0.18911125,0.6184267,0.06302542,-0.6790966,0.053656314,0.48765454,-0.733732,0.0827793,0.051796313,0.4809692,0.11573963,-0.48312217,0.41275212,0.84406257,0.5859171,0.3785012,-0.82813185,-0.26477,-0.13008809,0.11238533,-0.6284069,0.40020412,-0.43308303,0.6209409,-0.9983696,0.62689507,0.37189916,0.4442639,-0.122408874,0.23638703,0.030562263,0.5363346,0.1525133,-0.28272194,0.8264476,-0.084527135,-0.18672526,0.7238575,-0.38872164,0.35816056,0.31954658,0.8910468,-0.45402515,-0.47001112,0.9969301,-0.00942028,0.36434135,-0.5357505,-0.6722651,-0.2936713,-0.19083819,0.26218778,-0.511753,0.48731583,0.9989259,0.47697592,-0.37190655,-0.3455893,-0.052921023,-0.25822178,0.3062103,-0.89986116,0.35576427,-0.23053628,0.98307794,-0.51815665,0.7191598,0.32326633,-0.78822094,0.99656487,-0.9782045,0.26351848,-0.11576047,-0.13527913,-0.12144782,-0.3124397,-0.14167856,-0.20062073,-0.6606597,-0.57364476,0.3692873,0.45165068,0.5957791,0.52158517,-0.45061946,0.46970445,0.15454993,0.16611966,-0.22755633,-0.56408554,0.007383783,-0.9381696,-0.43787462,-0.32695407,0.44526118,-0.11231539,0.045789007,-0.3366359,-0.7597754,0.7943836,-0.92193264,0.31687304,-0.24592347,-0.20325686,-0.061149158,-0.12724788,0.6240914,0.21696816,0.37902987,0.6438368,0.37978745,-0.019446911,-0.014626115,-0.31083196,-0.62140644,-0.3354329,-0.6905362,-0.89915955,0.3520981,-0.5040295,0.5836518,-0.12048037,-0.52981603,-0.96549726,-0.51217854,-0.01618113,-0.47983047,0.17498362,-0.2050976,-0.20559052,0.9998532,-0.16309251,-0.332511,0.045911573,0.60149837,0.013116679,0.34243813,-0.8908502,-0.06499561,0.75997686,0.7958037,0.7289759,0.1143124,0.12998755,0.80908054,-0.041038316,0.17659156,0.6074066,1,0.27643973,-0.3248136,-0.6289278,-0.4686866,-0.6419983,0.18791905,-0.5258588,-0.55944544,-0.014391343,-0.013782148,0.40463182,-0.028602842,-0.28722677,0.5091493,-0.738431,0.24255781,-0.31112793,0.6274682,0.7543735,-0.93593514,-0.056470167,-0.5986432,-0.0942775,-0.67179394,0.0978396,0.49609554,-0.2698628,-0.020533936,0.18565543,-0.42886776,0.009733543,-0.5222839,-0.6459009,-0.35716623,0.61867005,0.3936818,0.46403268,0.32255265,-0.09473069,0.58280486,0.9999168,-0.35017815,-0.96765804,0.29032445,0.99989754,-0.5504615,-0.86758983,-0.999285,-0.025428575,0.18904623,0.37117586,-0.3101286,0.19487235,0.4465104,-0.26498252,-0.7020244,-0.13622059,0.20431785,-0.6433008,-0.54236174,0.285704,0.60176164,-0.9999953,-0.99499565,-0.81158316,-0.08192183,0.1830138,-0.21561153,-0.38396424,-0.6994127,-0.8054782,0.5155239,-0.20814775,0.782158,-0.69913816,0.32484034,-0.008298603,0.07504182,0.3029478,-0.11629292,0.13708033,0.09369682,-0.99994755,-0.68671536,0.25306675,-0.046655394,0.3002811,0.24204938,-0.9249586,-0.14023879,0.54726017,-0.26212713,0.22063829,0.35127655,0.754562,0.90372944,-0.39482918,0.09138327,-0.87093997,-0.07891779,-0.7508333,0.36832452,0.0716904,-0.15215637,0.2612306,-0.37255624,-0.26956934,0.28258556,-0.6294128,-0.5717268,0.099004626,0.10838317,-0.08512626,0.79428935,0.04538791,-0.46226126,0.30134913,0.97271794,-0.41085038,-0.22828817,-0.3738871,-0.61991024,-0.16479829,0.9999886,0.4719246,-0.07734303,0.7413755,-0.37464866,-0.12127446,-0.13815595,-0.99288595,-0.4872112,0.33120677,0.8489778,0.79178715,-0.2354064],
    [187,1,"O=C1c2ccccc2C(=O)N1CCc1noc(-c2ccc(CN3CCCCCC3)s2)n1",0.6888443,0.11208453,0.664699,0.4697574,0.28368813,0.12549837,0.027720341,-0.34788454,0.08205902,-0.08865751,0.6582785,0.32726344,0.6250196,0.0871131,-0.55554366,0.44202113,0.25466478,-0.19845994,0.44805253,-0.40082496,0.09164237,-0.13436502,0.37770042,-0.17640188,0.2580575,-0.12706672,-0.09226699,-0.015462951,-0.7672248,-0.32082576,0.11235807,-0.4694515,0.1872574,-0.05539679,0.087272465,-0.5639494,-0.06908949,0.4978822,0.9994898,-0.33672324,-0.56863636,0.80601704,0.015574914,0.6419268,-0.42621574,0.9097716,0.32973692,0.48759925,0.18493105,-0.38618132,0.87278885,0.11471195,0.27401757,-0.7447224,0.8460981,-0.7203269,0.8269423,-0.912102,-0.2678067,-0.044686656,-0.09226939,0.13297985,-0.77618325,-0.1650212,0.30197936,0.5580849,0.4286992,0.43278506,0.4226543,0.59564954,-0.97738,-0.91135544,-0.4743315,-0.5284096,0.065259255,-0.24977212,-0.19366717,0.4957112,0.56152797,-0.9994414,0.56497884,-0.3207016,-0.89268506,-0.25705546,-0.049452346,-0.9156363,0.124138504,0.07489789,0.71509826,0.08481542,-0.34584734,-0.06371982,0.06966709,0.645908,0.9994321,-0.14663264,0.012280691,0.13025974,-0.06022415,-0.33388788,-0.010848552,-0.32740784,0.41417632,0.9986742,-0.9996535,-0.9389256,-0.14776543,-0.62831134,0.9518032,-0.10470518,-0.21889958,-0.14451876,-0.4596767,0.24359328,0.033310972,0.13971497,-0.007522015,-0.58956105,0.4392195,0.33353713,0.39516783,-0.62253636,-0.23770238,-0.1466032,-0.33741674,-0.3472435,0.17125514,-0.073304765,-0.29260987,0.99914825,0.3782257,0.043626722,0.6445068,0.7397243,-0.6144963,-0.9862925,-0.78312147,0.2500488,0.74173135,-0.8598127,-0.99999976,0.5520691,-0.50044507,0.671544,0.62618,0.18378401,0.16840996,0.42540747,-0.9991343,-0.1439854,-0.76481676,-0.3458125,-0.23068132,-0.5104843,-0.20114776,-0.15185213,0.019525934,-0.97855204,-0.1313676,-0.8994971,0.4809038,-0.69499403,0.6140659,-0.5145272,-0.5884193,-0.64749634,-0.7151411,-0.5268016,-0.6453619,0.011382938,0.7658301,-0.5562463,-0.49331906,0.58015734,-0.5361752,-0.28970173,0.8392246,-0.4927275,-0.6560897,0.2819239,0.6313861,-0.9520377,0.3686765,0.3736102,0.64135504,0.07576169,0.21143393,0.37450117,0.4767013,0.62824744,-0.7546875,0.13456638,0.02995359,-0.054365106,-0.33855942,0.093611605,0.43397352,-0.77894413,-0.07570632,0.5479145,0.17744453,0.123639464,0.26068535,0.27833176,0.21516551,0.5029273,0.05233237,-0.7532215,-0.24374524,-0.99990565,-0.6374269,0.3156636,0.0579676,-0.27343172,-0.53284717,-0.4318021,-0.31662223,-0.80846083,0.7112427,0.5389449,-0.3961582,-0.2950105,0.37773395,-0.40659797,-0.979056,-0.15839027,-0.18068261,-0.5223593,0.5819571,0.35984161,-0.5155443,-0.2256587,-0.35152486,0.1922303,-0.1527948,0.5197484,0.43944168,-0.42419896,-0.46283534,0.69225055,0.9092186,0.19005567,-0.733849,0.05075343,-0.06337596,0.18634218,0.6086407,0.38165823,-0.05227816,0.15834598,0.00288014,0.71494514,-0.6642691,0.20888792,0.56720173,0.1349062,0.09704441,0.47190535,0.3928173,-0.6680882,0.28142568,0.08190473,-0.3442591,-0.39588052,-0.43783003,0.717431,0.46528143,0.13976616,0.9454289,-0.4375663,-0.155484,0.9936029,-0.55184305,-0.052310247,0.26687026,0.8775909,0.56390715,0.01933166,-0.5944739,0.4797854,0.33599982,0.8982233,-0.14513889,-0.0374233,-0.25316158,-0.37913337,-0.5837624,0.95303273,0.907687,-0.56024367,0.34583935,-0.65104115,0.4682944,-0.90435046,-0.8823174,0.83938813,1,-0.9456192,0.51962465,0.6874883,0.4025139,0.10846398,0.14255078,0.4278167,0.6734138,0.74089026,-0.9996035,0.073757514,0.95932245,0.16776678,0.28736544,-0.34018552,0.08096946,0.44015947,0.26477242,-0.23551024,0.025177605,0.58012956,-0.9999585,0.32299933,-0.48632923,-0.36708355,-0.6833857,-0.7523642,0.43575352,0.412761,-0.30191562,-0.2268177,-0.49898842,0.16818567,0.3439966,0.44039392,-0.09029666,-0.2830841,0.19381827,0.13450734,0.34170347,-0.6150783,0.71945196,-0.75392455,0.4806454,0.82259953,-0.022982277,0.3723506,-0.56687236,-0.5278547,0.24177305,-0.07694009,-0.4722858,-0.9819233,-0.060860526,-0.3433071,-0.44962168,-0.54465044,0.11856747,-0.7289105,-0.49744913,0.9993575,-0.8608735,0.12998402,0.34446576,0.47288427,0.74354446,-0.45187846,-0.20336007,-0.77902246,-0.7446146,-0.34261084,-0.24444702,-0.08490105,0.17335717,-0.64719266,0.020887593,-0.84816206,-0.65211403,-1,0.22925489,0.7236276,0.7044933,0.28148422,0.6803017,-0.4944202,0.42377493,0.38282806,0.22398435,-0.36054206,0.28926656,0.19418728,0.48170206,-0.1643277,0.6636935,-0.6493677,-0.51659894,-0.47279993,0.12875628,0.45988113,-0.17266093,0.12797892,-0.782142,-0.66844,0.99415094,-0.34365833,-0.21551634,-0.23114835,0.3901462,0.4085708,-0.69566363,0.7019091,0.042447098,0.29304543,0.5158713,-0.4443432,-0.34717453,0.025843345,0.0580265,-0.14452852,0.99999976,0.08326217,-0.96908134,-0.10920141,0.99203986,-0.45510843,0.5495892,-0.99997306,-0.41661745,-0.9786544,-0.38118792,-0.651672,-0.4096993,-0.67449105,-0.7408675,-0.31128958,-0.1529079,0.4858666,0.17809533,-0.78466713,-0.48926964,-0.22844154,-0.9996077,1,0.94000083,0.71667284,-0.5431509,-0.28668764,0.4297249,-0.009361313,-0.06248822,0.15312481,-0.006720032,-0.59677994,0.59049565,-0.5675574,0.16477714,0.51374817,0.72158283,-0.07535751,-0.06523205,0.9836974,-0.9942799,-0.24764298,0.009568831,0.048365615,-0.4279063,0.00117889,-0.002741471,0.44414666,0.31413576,0.13073201,0.19656935,0.0750605,-0.22905977,0.98118633,0.500968,0.6772212,0.034110066,0.15106158,-0.3196963,0.5952576,0.07536245,0.07545521,-0.72860426,0.16143516,-0.18861656,-0.48508075,-0.59517056,-0.12163898,-0.30427754,-0.23833282,-0.20700647,-0.67917794,0.2511742,0.1945647,0.171377,0.99968696,0.14410292,-0.287306,-0.7954472,0.13295166,-0.30995905,0.9998634,-0.5927814,-0.14352609,0.8062859,-0.29237384,-0.3984036,0.10314929,-0.9991504,-0.09942238,-0.009293934,-0.5517968,-0.26493758,0.5538732],
    [188,1,"Cc1ccc(N)cc1O",-0.6883901,-0.3194854,0.39505705,0.070065,-0.2482573,-0.09593722,-0.60253036,-0.20068586,-0.16150191,0.3635153,-0.74516565,-0.55877715,0.22249116,-0.6599656,0.27293703,0.439389,-0.32881442,-0.3690202,0.14808878,-0.054047637,0.46375966,-0.9151306,0.5085736,0.4721999,0.15543734,0.035112094,0.04856844,0.15354864,0.069363296,-0.28590032,-0.12318731,0.5514805,0.16899101,-0.083772734,-0.45342976,-0.20515491,-0.15294431,0.58775115,-0.79518235,-0.9278285,-0.9682356,-0.47947317,-0.29227698,-0.3808243,0.22072461,-0.99631196,0.47252172,-0.03172726,0.85235107,-0.45570716,0.0687535,0.22331844,0.04513673,0.21393642,-0.94024277,-0.2530052,-0.5818859,0.97401667,0.4517319,0.19959928,-0.44821584,-0.041245136,0.11850776,-0.39707956,0.59167033,0.52307385,0.004177471,0.37998158,-0.10322169,-0.044468336,0.30080247,-0.9962144,-0.3643906,0.25959986,0.4474371,0.5223332,-0.15146746,-0.13379508,-0.047782067,-0.98432356,-0.91903853,0.32634202,-0.87920445,-0.2598523,0.24445745,0.7589576,0.27899748,-0.09455586,0.00322859,-0.30153143,0.21474361,0.22105716,-0.20679562,-0.002112681,0.7831057,-0.40237057,-0.49412584,0.005995873,0.6190585,-0.22005863,-0.1202335,-0.47686517,-0.106559284,-0.8164925,0.98947984,-0.001535825,0.10750776,0.12701863,-0.9992377,0.17191572,-0.2738644,-0.26866946,0.09340554,0.15027998,0.104347855,0.10424039,0.51182824,0.13772556,0.998256,-0.34737736,-0.3420907,-0.41367865,-0.11518985,-0.39858612,-0.024114618,-0.0710433,-0.47291055,-0.17720523,-0.16994697,0.99494404,-0.23314305,-0.04121151,-0.14431475,0.066121906,-0.27899912,0.73251,0.5505285,0.34140697,-0.6773788,-0.004424928,-0.99049497,0.36531007,0.9828362,0.34602678,0.06341494,0.37570128,0.30385488,-0.55964035,0.99780226,0.028885402,0.07200792,-0.34153703,-0.408123,0.002804141,0.023729678,-0.09113304,-0.4692732,0.99910104,-0.25594896,-0.40406013,-0.9920541,-0.25128302,0.40524396,0.20547739,-0.28106922,0.27581254,0.8027329,0.15713392,-0.007399816,-0.028319014,-0.7265661,-0.2491414,0.18353313,-0.7269629,-0.039550226,-0.9739593,-0.8519107,-0.21467713,-0.47565103,-0.10232581,0.6126137,-0.48230952,0.11932758,0.007843295,-0.8706613,-0.5009217,0.35570756,0.16492559,-0.27591467,-0.17056377,0.9161296,0.3801795,-0.04216454,0.1612211,0.13255961,-0.27825946,0.2927351,0.32571936,-0.48607937,-0.4402817,-0.18852527,-0.15711457,-0.61620647,0.06723033,0.35628498,-0.10515468,0.22090897,0.40230918,0.013038033,-0.12253185,-0.17992947,-0.16224717,0.15650514,-0.56959736,0.25666255,-0.095236495,0.29316238,0.35268813,-0.20705514,0.15940794,-0.03254729,-0.3647366,-0.1674306,-0.19521013,0.9999948,0.07630441,0.04128592,0.3025046,0.36669493,-0.58771634,-0.03671369,-0.7083002,0.5594621,-0.3864439,-0.004182195,-0.5259858,-0.5536068,0.3200497,0.2801844,0.30774772,0.8863481,-0.02346625,0.011851098,-0.38092765,0.64665765,-0.16687523,0.003979792,0.61885774,-0.39231688,-0.33420905,-0.38042384,-0.9966837,0.31693965,-0.21753676,-0.16031691,-0.115337335,0.20785332,0.11392394,0.25454602,-0.08303525,-0.65677315,0.5443222,0.046818513,-0.27254778,0.39332837,-0.1524697,0.1604061,-0.01435744,-0.9936837,0.55189556,-0.07780085,-0.81359845,0.087084346,0.47837347,0.07782892,0.51562965,-0.179158,0.36513945,0.11686325,0.6486127,0.061906587,0.99863744,0.05134056,0.6877278,-0.20972016,0.15287057,-0.252994,-0.82550573,-0.60501385,0.09890722,-0.21802095,0.9991079,-0.09938559,0.849825,0.20154488,-0.015108663,0.9962217,-0.54965806,0.23445238,-0.08253739,0.01949563,0.39424658,-0.34980932,-0.13933893,0.2852085,-0.42716673,0.99924433,0.32675168,-0.5106313,0.035942823,0.08790479,-0.31745765,0.28630897,-0.4959336,0.73311955,-0.52261055,-0.04043374,-0.142871,0.7917922,-0.021649577,-0.15739861,0.5537863,-0.17554851,-0.57844114,-0.5537702,-0.09223669,0.39566487,-0.8218035,-0.15312542,0.13172685,0.2860299,-0.40068555,0.45886958,0.099426016,0.22499105,-0.41943425,-0.14071004,-0.09292166,-0.60807043,-0.3724835,-0.013184707,-0.3028318,-0.2667806,0.24981713,0.19467357,0.6749571,-0.087117836,-0.42966425,0.3893339,0.96381414,-0.99203676,0.005384937,-0.6529923,-0.2774797,-0.008592493,0.3823232,0.18663277,0.9639111,-0.11359038,-0.32273388,0.22103944,0.1803721,0.30906576,0.19126482,-0.4880913,0.1493814,0.21810599,-0.5584451,-0.35321277,0.18560788,0.40640584,-0.04693343,0.57215905,0.96713525,-0.025021786,1,0.2655484,-0.14311233,0.04328195,0.16227134,-0.8568371,-0.44439262,-0.12081082,-0.5961946,-0.38951743,-0.42529127,-0.1735486,-0.1614219,-0.12263838,0.7012323,-0.03630419,0.19168395,0.22063795,0.1544305,-0.58331794,-0.11680711,0.16916221,0.73185545,0.8957473,0.6074356,-0.85001016,0.25068048,-0.43489638,-0.15917403,0.34201807,-0.5965279,-0.5626013,-0.34085697,-0.12473454,-0.35925293,0.62273985,0.6975436,-0.23306097,-0.14122005,0.46672174,-0.29455203,0.9641443,0.19782904,-0.99664086,-0.30412608,0.9928183,0.28392717,-0.30569226,-0.9550015,-0.30512148,0.7932316,0.5759457,-0.069178335,-0.6731587,0.16859683,-0.13698672,0.7079338,-0.08146805,-0.46323,-0.24114573,0.1834295,0.050057746,-0.07799654,-0.9996917,-0.9994994,-0.996587,-0.29399604,-0.14040007,0.66043115,-0.14087416,-0.6956636,-0.730008,0.45534924,0.0644316,-0.4083915,-0.8307588,-0.5074563,0.19142799,-0.4917683,0.51185656,0.25828466,-0.24359384,-0.99376386,-0.99974924,-0.59765345,-0.25970122,0.20487648,-0.4500316,0.122177914,-0.9245295,-0.15779172,-0.55761147,-0.20923404,0.2165059,-0.0924055,-0.4183,0.92843443,0.14413485,0.7962417,-0.082972735,0.6518718,0.22219522,-0.85734284,-0.23407754,-0.061663486,-0.5497783,0.8438565,-0.12397416,-0.07775815,-0.39137825,0.024314119,-0.27768233,-0.6551305,0.16005062,0.5707573,-0.09639109,0.3359943,0.32517755,-0.97979677,0.24029614,-0.53061503,0.28765428,-0.35230467,0.204425,0.9988384,0.07808535,0.13458042,-0.394969,0.75074065,0.5872987,-0.29428843,0.9255981,0.258588,-0.45913866,-0.10840678,0.5881455,-0.004806776],
    [189,0,"CC(C)N1C(=O)N(c2ccccc2)CSC1=NC(C)(C)C",-0.38765657,0.053361885,0.41163296,0.47089353,0.21932974,-0.12681569,0.006850911,0.38245377,-0.5924144,0.32104668,-0.66251415,-0.22008549,0.47983563,0.19441149,0.2339729,-0.22839703,-0.3870056,-0.14805387,0.4506221,0.48754,0.45488545,-0.37604332,-0.010080799,0.45064247,0.4493289,0.41526738,-0.34867662,0.74700296,0.19096981,0.5200598,0.1300351,0.015734132,0.10643306,-0.002932518,-0.30588987,0.69862723,0.8193771,0.5486019,0.9980013,-0.78167635,-0.97253764,0.115869574,0.42647904,0.45494404,-0.11966636,-0.6855413,0.055336874,-0.44497913,0.89770967,-0.14436716,-0.1137793,-0.15367891,-0.2098224,-0.4988601,-0.19634403,0.07210959,-0.47078982,-0.30233833,-0.031685494,-0.14691988,0.18488114,0.25150687,0.4853253,0.41671264,0.04624194,0.60835314,-0.05933144,0.50499696,0.22493225,0.013918893,-0.7405867,-0.7882756,-0.48343834,0.36099,0.59979874,-0.5805323,0.6786338,-0.5988382,0.42776927,-0.999778,0.116422296,-0.14586934,-0.8480945,-0.2698235,-0.4168389,-0.7860345,0.1490156,-0.19582798,-0.21468344,0.038156185,-0.60993344,-0.5484544,-0.39378634,0.68186456,0.99380714,0.19404931,0.2249905,-0.43845642,0.39915884,-0.75655025,-0.12244197,-0.5446107,0.25429842,0.49696046,-0.98387843,-0.18604586,0.17069672,0.05607025,0.97618186,0.2122933,-0.34954405,-0.13140902,-0.38717926,-0.20560274,-0.32795063,0.092898466,-0.520649,0.673401,0.9949415,-0.8142207,-0.3462241,-0.024079086,0.45481986,-0.30621246,-0.6414947,-0.53059167,0.52213675,-0.06300858,0.50332123,0.99970746,0.5688203,-0.31018916,-0.18932366,-0.003496658,0.029112548,-0.99134624,-0.31198728,0.55535334,-0.51218265,-0.6796146,-0.99972534,0.80213195,0.9205155,-0.3039596,-0.60799044,-0.10754002,0.2520802,-0.12852359,-0.6999355,-0.46301308,-0.46638092,-0.33107668,0.18286858,0.5419419,-0.31775108,-0.54879695,-0.7135768,0.6413303,-0.68065023,-0.7797736,-0.8168833,0.27769136,-0.38561335,-0.345586,0.28142643,-0.7460537,0.5947338,0.18785146,-0.5670009,0.7908203,-0.06387118,0.031749863,0.3905738,0.7923421,-0.22927628,-0.9409839,-0.6588816,0.5224636,-0.15456636,-0.13206114,0.17583618,-0.40400854,-0.09501202,-0.045080878,-0.24394809,0.15939617,0.8142242,0.1491805,-0.048124287,-0.78264695,-0.77592933,0.44270194,0.21215938,0.8935909,-0.64915335,-0.35627538,0.72936183,-0.80787706,0.5808593,-0.12465511,0.25453106,-0.31190154,-0.37273073,-0.7074678,-0.36905947,0.38602483,-0.070472576,0.065505214,0.56018615,-0.9998903,-0.6197012,0.73021835,-0.538528,0.103539966,0.5433047,0.09213998,-0.18693744,-0.40248913,-0.38120824,-0.4274294,0.8033786,-0.11171751,-0.8196625,-0.32269087,-0.95563227,-0.18755147,-0.31679472,-0.5355597,-0.2594962,0.8535302,-0.5241458,-0.5024368,0.6321735,-0.6703829,0.41218638,-0.383527,0.12845542,0.011552168,0.12966043,0.048401743,0.81172854,0.50112295,-0.072212055,-0.62222505,-0.09229134,-0.5812232,0.1183133,0.34912896,-0.51115686,-0.5539601,0.68417877,-0.9717854,-0.58481044,-0.3792999,0.850975,-0.8059165,-0.47531036,0.06359836,0.20368257,-0.13164721,0.20838907,0.40438464,-0.17553137,0.32313508,-0.4219785,0.32477617,-0.034358818,0.7054426,0.76006985,-0.50322855,-0.14498714,0.9943806,0.50415605,0.48488647,0.027583024,-0.33771506,0.8002232,-0.7678513,-0.848954,-0.63154656,-0.11424166,0.9970619,0.30437002,-0.5595808,0.19496591,-0.407283,-0.49086192,0.9182155,0.8693827,0.30891177,0.3699807,0.967441,0.12704054,0.78864413,0.40119234,-0.28840435,0.9999607,-0.9858229,0.3061473,0.29241845,-0.09483875,0.18646526,-0.060898084,-0.9382571,-0.60878783,0.69941556,-0.6935097,0.22521925,0.39728025,-0.040572084,-0.2800927,-0.06729489,-0.197105,0.110289164,0.60487247,-0.7315263,0.7361888,-0.11228124,-0.999947,0.182487,-0.31412622,0.13290864,0.29234347,-0.5776788,0.07065307,0.3717189,-0.8312081,-0.8984717,-0.4400273,-0.40761697,-0.003139061,0.52679116,0.48400682,0.1983445,-0.04942288,0.6532409,-0.5333733,-0.020370424,-0.51613635,-0.11698137,0.311038,0.45647398,0.30980134,0.26816955,0.07252764,0.019835955,0.05951295,-0.2246413,0.08813672,-0.71656567,-0.9456916,0.17000858,0.38044214,0.5362368,0.20710911,0.34320632,0.001738894,0.9998938,-0.7724125,-0.46523276,-0.27554846,-0.56959224,-0.84039307,0.10114007,-0.6554185,-0.15559775,0.059235234,0.18563356,-0.5042651,0.61273056,-0.55905026,-0.43690914,-0.003583598,-0.6125484,0.22483873,0.99708176,-0.1881725,-0.13379087,-0.5649652,0.23785932,-0.39754045,0.27772054,0.12750942,0.2846177,-0.37038285,0.069301195,-0.55159116,0.5528599,0.56893563,-0.5102071,0.2977793,0.17078993,0.64563864,0.30495286,-0.006928135,-0.67856246,-0.5658846,-0.70298994,0.70958805,-0.83413815,0.034583606,0.20118527,0.23316178,0.7225885,-0.41121548,0.3089696,-0.4681286,-0.38747442,0.2558305,-0.0533719,0.62410027,0.25394285,-0.295862,0.6368738,-0.565301,0.54274964,0.9999999,0.25780973,-0.980622,0.5135802,0.9997654,-0.52919245,-0.16203813,-0.9998484,0.057812497,-0.6312436,0.38635582,0.21108118,-0.33289096,0.13372117,0.064013496,-0.10321152,0.5605979,0.30667657,0.040586423,0.26751095,0.16944036,-0.380877,-0.9999508,0.98268694,-0.80077803,-0.22783658,0.012537538,-0.7417611,-0.6763855,0.34078562,-0.6605418,0.45019627,0.093580276,0.38462695,-0.31315514,0.23205772,-0.31499287,-0.34503648,0.61556756,0.2769833,0.030161522,0.30265796,-0.9998195,-0.057938494,0.10175765,-0.43419418,-0.32830223,-0.0776371,-0.9506426,0.23338075,0.512293,0.29846185,-0.22585097,0.19356962,0.34823406,0.78454137,0.32112357,-0.16045147,0.4390321,-0.3758029,0.22299129,-0.37788847,0.74262404,0.28589496,-0.09213796,-0.45492426,-0.97402287,-0.5219317,0.07573473,-0.19201733,0.35360995,-0.6729786,0.46814427,-0.447197,0.297856,0.15942053,0.4502489,0.9833855,-0.1317021,0.70849687,0.023956187,-0.34670547,0.2005316,0.9996254,0.4382256,0.32473385,0.3214626,-0.37468693,-0.18907753,0.23613575,-0.99465597,-0.21521114,0.35166565,0.07748252,0.30969402,0.78790206],
    [190,1,"Cc1cc(N=Nc2ccccc2C)ccc1N",-0.21375498,-0.122199945,0.67194027,0.45845821,0.07998928,0.06827907,-0.14978348,0.2993342,0.057461884,-0.12211553,-0.9118906,0.41260865,0.13604873,0.13031213,-0.55010265,0.033422127,-0.16405782,-0.34212974,0.057088625,0.15378438,0.6229592,-0.5708122,0.36535934,0.7440427,0.1560511,-0.20127648,0.30712324,0.17116806,-0.39570245,0.014228092,-0.24301997,0.4256131,-0.35265586,-0.016421366,-0.5421466,0.12339808,0.30461287,0.592535,0.95684314,-0.92851037,-0.9651833,-0.4237873,-0.4754944,0.008358993,0.4774735,-0.9703666,0.089126974,-0.15090467,0.9588209,-0.11253943,-0.47624645,0.24508364,0.43854478,-0.38414598,-0.8730489,-0.052963417,-0.8355498,0.82100815,0.6725484,0.22855937,-0.122351944,0.21074377,0.41661823,-0.2226764,-0.13281523,0.5935423,-0.15453471,0.40290117,0.43202028,0.49761713,-0.28985628,-0.65985775,-0.03491925,-0.66422725,0.42926586,-0.5371554,-0.41232374,-0.5169528,-0.13936855,-0.989705,-0.48845336,0.35248017,-0.84431815,0.45730603,0.68960166,-0.88218874,0.08699579,-0.16882534,0.029882755,0.14926268,0.278225,0.3261321,0.1860044,0.52080035,0.98378825,-0.13317564,0.14384593,0.4724542,0.43383658,-0.38923284,-0.25728676,-0.78069896,0.27031425,0.85868305,-0.2369683,-0.5813207,-0.27622837,-0.23864408,-0.91311496,-0.4878729,-0.4661801,0.24538891,0.12570672,0.54724383,-0.39458612,-0.5049143,0.69449836,0.31849512,0.99631774,-0.7064614,-0.17567973,-0.45869556,-0.24226663,-0.36402845,-0.5662016,-0.10417187,0.17857781,-0.06652462,-0.08000762,0.999924,0.12806475,0.006246626,0.21351917,0.08910925,0.20231,-0.55706954,0.3303593,0.526639,-0.4250766,-0.3716438,-0.9997362,0.6201738,0.9766154,-0.31215087,-0.41962007,0.063733846,-0.43366998,-0.016401429,0.74360913,-0.28537494,-0.26637954,-0.33459422,-0.42212626,-0.028418755,-0.2471175,0.41470596,-0.13752042,0.9780625,-0.45854264,-0.6699402,-0.9578375,0.07483056,0.07912671,-0.251819,-0.2771139,0.22350737,0.41362014,-0.68152976,0.20300502,0.530609,0.07912592,-0.34926707,0.45315763,-0.46094114,-0.36507717,-0.87378144,-0.79624766,0.30992144,-0.37985954,-0.34800622,0.718244,-0.56515545,-0.37990394,0.15280285,-0.5225642,-0.24236107,0.37065035,-0.42746338,0.35641226,-0.16420737,0.11564898,0.19851767,-0.41697237,-0.33843556,0.071271904,-0.36794952,0.30963826,-0.16623034,0.071947984,-0.09468903,0.48928326,-0.84936005,-0.78068,0.01578221,0.06695998,0.10084889,-0.50658613,-0.37901524,0.60229105,-0.9992247,0.40631807,-0.3513303,0.2880406,0.17340544,0.6125084,-0.1827865,0.14285944,0.14667316,-0.17826359,-0.45574182,0.6771361,0.3004939,-0.4104813,0.62230164,0.97678703,-0.38283116,-0.48670968,0.21760415,0.66502476,0.49164432,0.07459073,-0.45932516,0.43200338,-0.67877656,-0.08923924,0.34902886,-0.13103145,0.24694034,0.31395704,-0.19311579,0.95286006,-0.6135148,0.070890985,-0.63405246,0.77492267,-0.4932385,0.19126771,0.34655845,-0.3797738,0.20810176,0.14823145,-0.9733624,0.5338124,0.7577183,-0.1828027,0.64907426,0.13168973,0.28676116,-0.09217031,0.03091226,-0.15991709,0.725223,0.30221346,0.10641349,0.36886972,0.45946276,0.29326606,-0.5148605,-0.95718014,-0.3000898,0.15981205,0.9474566,-0.5625774,0.027000932,-0.14852706,0.07168535,-0.3540736,0.03310097,0.015068123,0.67953426,0.42448428,0.9989672,-0.122221656,0.45385742,-0.032850172,0.39789847,0.21789764,0.72896725,-0.002744846,0.44058883,-0.79473466,0.99602044,0.060411077,0.19717033,0.07899028,-0.008819195,0.9999052,-0.9867024,0.09622578,-0.33464792,-0.17043352,0.5575498,-0.7485695,-0.6080459,0.6493415,-0.65201837,0.73184466,0.5709476,0.6316137,-0.5105934,0.26013607,-0.64143634,0.40063044,-0.46778294,0.83337265,-0.50251585,0.61041015,0.0158549,-0.99026847,-0.008868738,-0.4123337,0.57219994,-0.33404067,-0.884735,-0.5038675,0.121617325,0.82120544,-0.93267864,0.5783487,-0.53114814,0.6186093,-0.2968691,0.11375063,0.50057566,0.30363894,0.7032098,0.47695535,0.093792036,-0.13883273,0.21992818,0.26189545,0.10305999,-0.51333034,0.50784284,0.060958616,0.5464395,0.40585297,-0.47515842,-0.16158375,0.51080215,-0.9934528,0.06409616,0.013472969,0.59696037,0.4731897,0.7365555,0.28180683,0.9996199,0.16476597,-0.5131221,-0.08457826,-0.59025675,0.47411224,-0.44255817,-0.87222624,0.5846971,0.38367093,-0.48011363,-0.4436271,0.34113428,-0.22414729,0.101019695,0.40203157,0.5952398,-0.33162037,0.99884653,-0.32986927,0.12388252,-0.3327248,0.028114254,-0.18909565,0.12768662,0.3305213,-0.15260479,-0.092725694,-0.29958284,-0.44686633,0.41051993,0.17033643,0.76549244,-0.1980312,-0.5227452,0.55834794,0.42836973,0.061863612,-0.09502889,-0.038387932,-0.50964135,-0.20919546,0.11726712,-0.65950066,0.002658776,0.2696257,-0.2910378,0.4766037,-0.6306337,-0.10026239,0.6587275,0.3331947,-0.16769083,0.69160044,0.1609103,-0.29236916,-0.48359206,0.22183877,0.102783285,0.99997747,0.23481384,-0.9748317,-0.71584207,0.9987704,0.32032612,-0.49554598,-0.9996486,0.04869022,-0.11658829,0.39923808,-0.2643901,0.11360444,-0.5875375,-0.36553305,-0.23929021,-0.49100792,-0.44935203,-0.26213467,0.18382712,0.16402222,-0.34468275,-0.99987644,0.9912727,-0.9476238,0.16863887,0.2667576,0.75847894,-0.876083,-0.75340974,-0.61551577,0.68398935,0.19049372,-0.1908719,-0.9062963,-0.101221375,0.42830032,-0.3607463,0.36691612,0.3544823,0.39111453,-0.7510904,-0.99981874,0.1292134,0.14837003,-0.33740216,-0.49265876,0.08018846,-0.96523106,0.23148233,0.35274005,-0.5032198,0.2781674,0.175379,-0.58194065,0.977461,-0.17785785,0.08531824,-0.30647972,0.3250431,0.44894272,-0.45378762,-0.10071438,-0.28154916,0.4593323,-0.013454531,-0.6457013,0.36453578,-0.08299471,0.5363683,-0.20155215,-0.43348694,-0.07347797,0.7366823,0.2505587,0.7231668,-0.6597914,0.7618077,0.17435768,0.44577348,-0.34041193,-0.6137079,0.4087444,0.9996669,0.5112678,0.5896565,0.027331155,0.12853512,0.28852788,-0.23650935,-0.8863873,0.54033905,-0.77330995,-0.18282339,-0.029450307,-0.30599242],
    [191,0,"CC12C=CC3=C(CC=C4CC(=O)CCC43)C1CCC2O",-0.013559499,-0.32849234,0.35263345,0.019861331,0.16887948,0.51032096,0.48476538,-0.2432845,0.15620105,0.4103457,-0.27006385,0.23833677,-0.20048116,-0.2562247,0.17226833,0.80248356,-0.52693295,0.18255709,0.2832782,-0.13910954,0.39347503,-0.12881719,-0.52545387,0.14922,-0.25223523,-0.13603497,0.2251639,-0.14830096,0.2871949,-0.7563624,-0.45006347,0.37582022,0.48939213,0.52251554,-0.30258858,0.02405603,0.055743814,-0.16860418,0.99798316,-0.3875364,-0.57086545,0.12241031,-0.060004663,-0.31852818,0.27862525,-0.64102334,0.04772518,-0.19119851,0.9777692,-0.73223585,-0.07332721,0.12601276,0.06170355,0.70542675,-0.8477492,0.06147359,0.19531995,0.26438558,0.3152502,-0.5358241,-0.40830216,-0.068374656,0.45318466,0.3919829,-0.16317733,-0.012927929,-0.140897,-0.48431966,0.22037251,0.11961123,0.42466775,-0.7024539,-0.11887167,0.82682383,-0.16108914,0.639352,-0.39923394,-0.11674137,-0.10798304,-0.99929416,-0.36922446,0.6273515,-0.48593792,0.4742132,0.28835458,-0.793408,0.084724694,-0.45206097,0.45998764,0.22089174,-0.43785456,0.36005667,0.6472253,-0.21850148,0.9895593,-0.28392395,0.7011453,0.62314934,0.4312741,-0.21109907,0.32163832,0.697695,-0.3287021,0.75998455,-0.9893847,0.6004847,-0.13326329,0.102726236,-0.5589482,-0.025084795,-0.7301252,0.308236,0.023976265,-0.20807952,0.45346367,-0.20559457,0.15799975,0.35760242,0.98934263,0.35278228,0.22507153,0.26105788,-0.34908634,-0.02755186,0.5473341,-0.23151435,-0.5303525,-0.15367219,-0.48976234,0.9997537,-0.3265008,0.43862563,0.5933071,0.1248355,0.038498107,-0.9585981,0.6737063,-0.25887576,0.61175454,-0.39572316,-0.9996,-0.1310593,0.9022987,0.00337646,0.01993671,-0.29182318,-0.059920028,0.59967273,-0.88817996,0.5361596,0.37304357,-0.89824224,0.8169805,0.6492702,0.20932339,-0.5178863,-0.29619282,0.34379166,-0.2598334,-0.8585971,-0.8852399,-0.49263442,-0.15150918,-0.14211008,0.1430843,-0.6964409,0.5763479,-0.58076584,0.23665239,0.051580556,-0.6027554,-0.028936755,-0.16068675,-0.37417316,-0.54905236,-0.94920933,0.88725424,-0.00053676,0.54514027,-0.06707031,-0.29296285,-0.6779971,0.37427828,0.47826415,0.27713743,-0.3107114,-0.91198146,-0.62116534,0.582103,0.45683917,-0.44133168,-0.4218839,-0.4351241,-0.16608444,0.5826728,0.20369077,0.10675579,-0.71352965,0.42756042,-0.4680121,0.510592,0.18965076,0.40057662,-0.3863379,-0.43454856,0.6100914,0.3272238,-0.42621058,0.43582696,-0.99994475,0.45799008,-0.38182178,0.45919007,-0.5177082,0.103799015,-0.5422835,0.5271051,0.6287074,-0.54519165,-0.74649775,-0.32845047,0.44706646,-0.84691703,-0.6398822,0.9706494,0.4775084,0.001984366,-0.027758984,-0.18523163,0.18551937,-0.35960838,-0.59807813,-0.06788301,-0.61910594,0.4318279,0.096904226,-0.11941833,-0.33625504,-0.6952096,-0.5376523,0.8276219,0.46049923,0.8385448,-0.6681602,-0.87472063,0.24300553,-0.3716799,0.43899646,0.3039798,-0.32972345,-0.22377834,-0.40987355,0.38103026,-0.1707062,0.06062125,-0.19979699,0.10122142,0.76018965,-0.4528897,0.33437237,-0.8725683,-0.037115365,0.4169176,-0.007713346,0.13026609,-0.32652056,-0.7227466,-0.18951505,0.56150943,0.031438313,0.1367737,0.99963117,-0.36392748,-0.26919082,-0.2822313,0.4892231,-0.036958206,-0.7580044,0.5800097,-0.5628741,0.14424093,0.9974518,-0.24915405,0.4077134,-0.08558132,0.38752902,-0.27526915,0.7079478,-0.057806734,0.28280607,-0.60666794,0.95025826,0.5349013,0.11619458,0.43788514,0.65933615,0.9999816,-0.99274004,0.4271847,-0.07412908,0.4759133,-0.28443623,0.33785665,-0.42117605,-0.3267744,-0.9870324,-0.8306848,-0.2948019,-0.68203825,-0.38334736,-0.2996845,-0.35534456,0.6164381,-0.21422902,0.58848614,0.3416062,0.36632147,0.27492687,-0.9889365,-0.18185629,0.7257602,-0.32521963,0.054810535,-0.28520432,0.005395772,0.12260026,0.15428385,-0.687985,0.07926054,0.1940747,0.2738295,-0.4831597,0.6113441,-0.06286226,-0.012119792,0.7202847,-0.14686398,-0.23145555,0.0740985,0.07306579,-0.08834775,0.4548651,0.4122302,-0.38693112,-0.69182956,0.44649878,-0.06338773,0.48561648,-0.14807217,-0.5452625,-0.9577527,0.3014512,-0.095193826,-0.2237691,0.5985296,0.43218967,0.17781349,0.9994993,-0.290273,-0.07264482,0.38183272,0.03353491,-0.044039574,0.7643717,-0.8652844,0.29189426,0.47220287,0.7449186,-0.40027967,0.43736836,-0.73357266,-0.05386289,0.8176881,0.18384223,0.43160313,-0.99999017,-0.3197762,0.64394474,-0.37212804,-0.48148552,-0.88795644,-0.31609112,0.08394108,-0.64327925,-0.5442148,0.07369545,-0.39009538,-0.2995166,-0.26871717,-0.65592265,-0.45963138,-0.22789265,-0.41891494,-0.87918097,-0.6794849,0.05358935,0.5855106,-0.2802345,0.6682426,-0.0097647,0.10084886,-0.25372005,-0.6720477,-0.5231715,0.111917906,-0.23348968,-0.61057115,-0.69727653,-0.1641738,-0.33208954,0.13503696,-0.5894663,-0.102185406,-0.30021602,-0.3074859,-0.43309125,0.9999462,0.44737875,-0.8954026,0.16245449,0.99194723,0.26197422,-0.31840292,-0.9995314,0.41906703,-0.076509684,0.016721716,0.07808708,0.30043617,0.5191919,0.12256637,-0.6400085,-0.17693888,-0.24947008,0.73060316,0.32828048,0.3359582,0.013146733,-0.9999425,1,-0.60842097,-0.6649611,-0.2120458,0.9602193,-0.22869442,0.02834607,0.5109421,0.20524709,-0.29793933,-0.5416833,-0.23489885,-0.09508217,-0.20833409,0.35538933,0.04123178,-0.59957105,0.40679863,0.3040825,-0.99978167,-0.30784854,0.22106211,0.4827315,0.23972096,0.20978463,-0.9402051,-0.54624814,-0.5101563,0.29024452,0.29843313,0.78859043,-0.09011838,-0.105599895,-0.057228327,0.435586,0.21123433,0.4177939,-0.15936913,-0.10343261,0.15920089,-0.15467334,-0.3724316,-0.6442955,-0.9967449,0.56372064,0.15180919,0.23233443,-0.78536797,-0.19154881,0.17321074,-0.9633466,0.19547147,-0.27435905,-0.07564234,0.9892034,0.7061613,-0.4839546,-0.23333828,0.50849026,0.49850354,0.99980295,-0.30946797,-0.06910613,0.052701894,-0.32000118,-0.21794038,-0.44869116,-0.9982957,0.57327515,-0.001684718,0.32233244,0.75135684,-0.11625393],
    [192,1,"CCC(C)(C)c1ccc(O)cc1",-0.768205,-0.32602653,0.21914025,-0.09726687,0.2368426,-0.416152,-0.5890662,0.081017405,-0.10934269,-0.22999632,-0.8341255,-0.17404711,0.12483034,-0.7477307,-0.17380813,-0.013276422,-0.2139448,-0.53068817,0.17263438,-0.45393363,0.2120299,-0.83545005,0.38107473,-0.36476684,-0.000209466,0.6239781,0.32014787,0.10964796,0.79038787,-0.116343886,-0.4031419,0.62392694,0.41753078,-0.058445387,-0.24778666,0.31488782,0.24938487,0.57794243,0.2960877,-0.9350953,-0.99782085,-0.24337485,0.18002665,-0.03735304,0.29803377,-0.9953095,-0.05567797,0.10084894,0.9783055,0.09025157,0.70148665,0.21458754,-0.42286783,0.21195515,-0.9711361,0.14184047,-0.558504,0.9415179,0.490945,-0.15342093,-0.055774823,-0.48477286,0.37236094,0.14440633,-0.09445446,0.50257814,0.038048957,0.6172672,-0.09309163,0.41736504,0.7997489,-0.9218247,-0.23037033,0.40331575,0.6519129,0.24061203,-0.00441005,-0.3234394,-0.28845373,-0.9964961,-0.73045313,0.4019972,-0.8422902,0.033146035,0.4245563,-0.42249188,-0.12591456,-0.54007345,-0.07611447,-0.21378295,0.14339477,0.09664698,-0.070156775,-0.54633135,0.17356113,-0.36619347,0.7337373,0.15284403,0.34036458,-0.14619835,0.26353943,0.15908411,0.07998354,-0.35830826,0.86503106,0.47269654,0.26724327,0.4186018,-0.8914063,-0.29176763,0.3384636,-0.35334766,0.07338986,-0.19333549,-0.029977016,0.6369988,0.14258702,0.30027518,0.9991465,0.23345435,0.39940405,-0.31534615,-0.32574695,0.2267759,-0.4262059,0.14132915,-0.20871343,-0.058407664,-0.4450293,0.9998237,-0.17280558,0.0921697,-0.50859815,-0.24910185,-0.545853,-0.68862253,0.28818926,0.7277649,-0.80150914,-0.4728129,-0.996666,0.41250506,0.9965464,0.31787363,-0.26901254,-0.13180336,0.090355046,-0.35404313,0.9902237,0.1452204,0.15499541,-0.84737796,0.44332752,0.30024454,-0.49602112,-0.1806993,-0.00876545,0.99825805,-0.6298863,-0.53241324,-0.9918461,0.041930497,-0.4153516,0.40027338,0.29419535,0.22878376,0.8764362,0.41885105,-0.26015422,-0.38673124,-0.6713507,-0.34813842,0.425809,-0.095033206,-0.14740223,-0.9877883,-0.7264809,0.17317344,-0.6455344,-0.2884845,0.22409108,0.56317466,0.050321564,0.35016188,-0.80948704,-0.2853971,0.57982814,-0.18389267,-0.18305655,-0.17566085,0.4435217,0.22383614,0.13498501,0.3425353,0.35380825,-0.6429439,-0.009845905,-0.4303422,0.18320134,-0.15779057,-0.38859937,0.26553792,0.5234364,-0.30615294,0.5140853,-0.32204434,0.23338068,-0.20849241,-0.23863673,-0.95678407,-0.23406544,-0.091312826,0.53094214,-0.36372894,0.5551671,0.59433466,-0.0454777,0.3401265,-0.17693584,-0.018041303,0.02585425,-0.21205592,-0.05217616,-0.36489263,0.9975661,0.3479645,-0.03519821,0.019979173,0.038539533,-0.32473788,-0.22841688,-0.16540067,0.63425595,0.049645353,0.1564875,-0.32515442,0.037609804,-0.57227486,-0.44278443,0.018582195,0.93179405,0.55463344,0.13760144,-0.6107464,0.14991646,0.035905793,-0.045771517,0.16555458,-0.5880141,-0.03282499,-0.18477665,-0.9978329,-0.43707395,0.56734306,0.30765617,-0.47277743,-0.544087,-0.1179895,0.545297,-0.27590626,-0.63785094,0.7393699,-0.65289587,-0.545284,0.74964285,0.016261853,0.42818516,0.60307246,-0.58806276,0.1416051,-0.58006036,-0.2180291,0.30762112,0.41183186,-0.4099727,-0.39777863,0.06449549,-0.30468726,-0.20843706,-0.10131864,0.29086524,0.99946576,0.2343365,0.34746554,-0.031685513,0.18184495,-0.1476974,0.045440353,0.71109056,-0.008793265,0.23236324,0.999351,0.3008926,0.86116225,-0.009375905,-0.09344345,0.99735147,-0.9873173,0.38790098,0.15777068,-0.24918902,-0.19195403,-0.2026535,-0.046069253,-0.24489723,-0.8288904,0.99354327,0.58474874,-0.2996029,0.221861,0.1882831,-0.281189,-0.20848013,-0.45525786,0.91431093,-0.23824409,-0.40322545,-0.17873792,-0.9787935,0.24650502,0.22083639,0.047718387,0.57274514,-0.59869593,-0.45673275,-0.6837881,0.3407569,-0.971477,0.1366114,0.17713614,0.059782732,-0.27384326,0.14443636,-0.25948176,-0.26293987,0.6273407,0.43031478,0.27775872,-0.02767593,0.081599414,-0.39847422,-0.06268729,0.47136092,0.5873205,-0.18411215,0.21133946,-0.5103488,-0.33782822,-0.1836531,0.9157168,-0.99548876,-0.12796082,-0.5427777,-0.05839725,0.40100735,-0.12095488,0.28680497,0.99860245,-0.2848211,-0.58428144,0.3693942,0.14348923,-0.51891077,0.31405962,-0.83014715,0.05861415,0.11732017,-0.2917763,-0.11984071,0.6208036,0.74851733,0.22100538,0.13823152,0.94869775,0.6965882,1,0.18769963,-0.446598,-0.17447016,-0.1272788,-0.91167074,-0.6230221,0.04610489,-0.423507,0.12820122,-0.47432616,0.22655748,0.5022383,0.29161984,0.6867491,-0.105610654,0.3252059,-0.111244634,0.06583304,0.11087681,-0.5749786,-0.5914966,-0.4231155,0.777204,-0.095168084,-0.9805187,0.5641446,-0.18271682,-0.01891951,0.010974355,-0.46495387,-0.6362699,-0.5687746,-0.6081409,0.009891599,0.35439727,0.07875725,-0.29424566,0.27746716,0.35796344,-0.46273535,0.9999568,0.040766302,-0.9904101,-0.23426303,0.9992848,-0.46717644,-0.43142992,-0.99815977,-0.24387391,0.62926745,0.5238139,0.2977104,-0.5584881,0.584016,0.015389648,-0.39752513,-0.4468803,-0.49886298,-0.3437416,-0.3357275,-0.05450606,0.054254256,-0.99992496,-0.9992159,-0.99048954,-0.089002796,-0.38319936,0.11282194,0.021750927,-0.6163676,-0.67959094,0.10365447,-0.3952478,-0.31782866,-0.75484663,-0.64594525,0.020340847,-0.26597384,0.43905616,0.22051473,-0.07803621,-0.977332,-0.9999203,-0.5255034,-0.16757858,-0.11826165,0.40239206,-0.53072494,-0.9963637,0.0976396,-0.5306246,0.061304096,0.071625985,0.40281287,0.15042374,0.9397053,0.009154611,0.7373398,0.5960007,0.45143157,0.11801845,-0.8518489,-0.1992259,-0.3438172,-0.42607915,-0.103500046,-0.09279493,-0.046395972,-0.07891722,-0.6068149,-0.17111297,-0.641705,0.16739286,0.5807501,-0.10868718,-0.39685565,0.4227438,-0.74423957,0.40651664,-0.25628245,0.03267331,0.15218805,0.23711613,0.99967,0.44922772,0.3929723,-0.17730874,0.62875617,-0.25275832,-0.14439055,0.24996282,-0.3603651,0.36154065,0.13356869,0.7827325,-0.31668666],
    [193,1,"O=C(O)c1cccc(CC2COc3ccc(OCc4nc5cc(F)ccc5s4)cc3C2O)c1",-0.4780259,-0.39776418,-0.4967215,0.2640268,-0.11389555,-0.14726792,0.069879875,-0.4068997,0.09645239,-0.13762273,0.56077224,0.35951024,-0.10259863,-0.59603566,-0.03211635,0.21262169,-0.1257882,-0.2944025,0.53997445,0.07043742,0.39341155,-0.36487472,-0.5184596,-0.29614803,0.15822136,-0.27245113,-0.6768021,-0.6275209,0.2991271,0.1520683,-0.5566346,-0.048555482,0.69298375,-0.5178512,0.52305484,-0.5683948,-0.42223513,0.59705764,0.99968636,-0.55558366,0.86140496,0.42235753,0.60452646,0.18046515,-0.22487424,0.9504621,-0.3607486,-0.5952775,-0.26259315,-0.11155564,0.62299377,-0.004699906,0.4014028,-0.20597424,0.21464512,-0.6655518,0.02663995,-0.92450887,-0.19054192,-0.22546254,0.24356726,-0.18821074,0.43548658,0.47040522,-0.6101309,-0.31663546,-0.42317086,-0.1101667,-0.113924645,0.22217421,-0.9754163,-0.32764316,-0.71562725,-0.5554584,0.22480057,0.6069012,0.17129222,-0.31426772,0.032800898,-0.9956864,-0.5309593,0.42798743,-0.88306004,-0.452182,0.3287187,-0.9800258,0.032861196,-0.53891546,0.5559798,0.3455876,-0.33015257,-0.023636878,-0.22231944,-0.36771458,0.99816936,-0.019588659,0.64166605,-0.2251973,-0.2034063,-0.37458065,-0.11951413,0.04768351,-0.67722076,0.9915627,-0.9997639,-0.849014,0.000176322,0.27797937,-0.9991455,0.06274626,0.067637,0.29160053,0.4847935,-0.47411495,0.41857332,0.41241813,0.22851679,0.5109955,0.11722301,0.45554334,-0.5891831,0.54658186,-0.4766162,0.43424517,-0.4939039,0.34756595,-0.20410475,-0.15984127,0.42738456,0.99987304,0.53409904,0.41478255,0.39595917,0.46400118,-0.35541975,-0.71845555,-0.37959784,0.1993135,0.42532986,-0.25388673,-0.9999987,-0.36205637,-0.20277509,-0.20474595,0.4858658,0.28970215,-0.4540299,-0.36465326,-0.9994271,0.074379966,0.070326716,-0.7314166,0.28147718,0.70418197,-0.6052397,-0.07851842,-0.73829937,-0.9919984,-0.59316975,-0.2945286,0.6071064,0.15348163,0.3617082,-0.47062436,0.012747318,-0.22237082,-0.49112576,0.51741064,-0.694341,0.72159857,0.2509031,0.3503791,-0.3516364,0.21011527,0.34233993,-0.7762272,-0.5827239,-0.24882586,-0.8292639,0.3359623,0.21386293,-0.8474482,0.4033437,0.3248595,0.8916019,0.150696,-0.10120524,-0.5258022,0.15832765,0.3443737,0.05431955,0.48253852,0.1423751,-0.27386576,-0.30087152,0.628553,0.27647665,-0.12834315,-0.54581517,-0.22466403,0.38889188,0.21084163,-0.51157707,0.6740544,0.61125135,-0.5633989,0.48197934,-0.72203076,-0.4975156,-0.999769,0.5026923,-0.6386427,-0.47155586,-0.2639408,0.47182682,0.027379783,0.28538528,-0.18779516,0.88022935,-0.82092685,0.25958723,0.025938334,-0.09937005,0.35445607,0.9999946,-0.55766624,0.38257384,0.5355357,0.35593307,-0.318241,-0.3139188,0.13587506,0.41540027,-0.13972794,0.23081176,0.4699008,-0.5029155,-0.63344276,0.22325958,0.16629688,0.80363405,-0.28996235,-0.2624094,0.07101877,0.7559617,0.46183154,0.52034944,0.18827383,0.698216,-0.087671965,0.20780584,0.6673906,-0.5764763,0.6268376,-0.495995,-0.0470437,-0.23045087,-0.20072775,0.08764205,0.039182834,0.15517002,0.42122734,0.10849137,-0.4824186,-0.26896334,-0.06892943,-0.18139586,0.3361507,-0.123723164,0.22779387,0.5903466,0.99947834,-0.087218754,0.3822089,-0.39573845,0.6843497,-0.12535453,0.03254925,-0.06517192,0.30862722,0.28501514,0.826683,0.08689897,0.54461366,-0.33587304,0.30181345,-0.045678634,0.27585202,-0.83392006,0.62713635,0.7178902,-0.8604689,-0.28976482,-0.75227267,-0.77000266,0.8546782,0.9999997,-0.98593605,-0.10934913,0.6382277,0.6297884,-0.038359586,-0.3504445,-0.52067405,0.114818916,-0.7430708,-0.9997974,-0.10368505,0.8824967,0.20882769,-0.2880065,0.39061886,-0.13190456,-0.4358443,0.4158265,0.60309714,0.11932323,-0.2637171,0.9290454,0.03235961,0.54584485,0.26623344,0.6026363,-0.8511581,-0.04586437,0.034407422,-0.3146351,-0.5151439,-0.6575102,0.33917448,-0.14298514,-0.1689247,-0.21615383,-0.4241246,0.21740156,0.72361267,-0.3060084,-0.14213654,0.17547594,0.36395466,0.6551558,0.16233012,0.19234355,0.033808276,-0.0493174,-0.5549941,-0.38927495,-0.4717557,0.26362336,-0.99071234,0.14548573,-0.24163318,-0.71736234,0.15742014,0.15041919,-0.17262086,-0.68137544,0.9970959,0.06153797,0.5628874,-0.36056307,0.300158,0.29311723,-0.56282216,-0.86984557,0.46595952,-0.4859601,-0.11557985,-0.053447187,0.6318742,-0.41472903,0.54967195,-0.032026112,-0.838171,0.09501051,-1,0.5396699,-0.22920305,-0.30932087,-0.4986517,0.6134438,-0.33045912,-0.06287135,-0.47432965,-0.44357315,0.48283887,0.20475549,-0.10880054,0.30494714,-0.43055618,0.55940384,0.8230911,-0.1136457,0.7953372,0.4469187,0.6846517,0.71588606,0.33614576,-0.8012562,-0.83651036,0.9675374,-0.11137224,-0.80361795,0.5022645,0.29003954,-0.3476936,-0.8619988,-0.32971343,-0.5022871,0.65097547,-0.22537053,-0.24717647,-0.43949553,-0.05670401,0.22462961,-0.73017174,0.86106294,0.25411838,-0.96618116,-0.26693246,0.9979993,-0.6543728,0.45569804,-0.98467225,0.5567902,-0.93407613,-0.61657065,-0.42777973,0.26965383,-0.05666508,0.6060112,-0.66935974,-0.082238704,0.6038338,0.100221895,0.61846495,-0.12266152,-0.11161894,-0.9996144,1,0.9634567,-0.43584293,-0.15918209,0.15057828,-0.07263873,-0.19948289,0.7088138,-0.6419584,-0.63218635,0.37868547,-0.7491041,-0.717538,-0.104979634,-0.050634414,0.39709523,-0.027080983,0.5450257,0.99375415,-0.98971224,-0.06025362,-0.002307195,0.34161627,-0.026244922,-0.6451859,-0.47687617,0.5704054,-0.5684205,-0.30772847,0.20459466,-0.2139442,-0.5301107,0.9907634,-0.52454555,0.42847714,0.5370667,0.08425672,0.055814996,-0.54682904,0.50196546,-0.3254313,-0.154064,-0.2979335,-0.974142,0.5049646,0.45740062,0.5232529,0.24911839,0.14352398,0.86684257,0.20877707,-0.44165254,0.12518002,0.27389377,0.99978757,0.22675164,0.1876098,-0.5859223,0.009020055,0.5362654,0.99993956,-0.114015795,0.31719568,0.301375,0.25030893,-0.40725452,0.24355116,-0.998833,-0.4017952,0.6717644,0.19822939,0.3912854,-0.09900575],
    [194,1,"COc1nc(=NC(C)C)[nH]c(=NC(C)C)[nH]1",0.08160028,0.10143419,0.0068577,-0.08137121,0.62264746,0.5486537,0.40801263,0.21885143,0.21704075,0.18672588,0.3759252,-0.21178396,-0.08921227,0.7674328,0.3073249,-0.76097953,-0.6372372,-0.41200712,-0.6179101,0.4105652,0.40136877,-0.44150648,-0.25641736,-0.07557132,-0.6123121,-0.51959604,0.4038169,0.36413267,0.10876326,-0.22928156,-0.47371992,0.14898527,-0.85400844,-0.41071898,0.36465,0.9175577,0.1808455,-0.51693267,0.9698329,-0.17196888,-0.6406356,0.20584749,0.6850897,0.16896455,0.5572383,-0.96477,0.3003785,0.19989842,0.65592057,0.40367463,0.27480233,-0.4750835,0.49478424,-0.23727144,-0.3544451,0.2123204,-0.62735474,0.4400783,-0.8009673,-0.38381314,0.19404668,-0.15571357,0.07994039,-0.8404617,-0.5843301,-0.10589093,0.62348044,0.077825,0.06606068,-0.3683519,-0.7826127,-0.99932736,0.6808155,-0.11328014,-0.41908094,-0.6190329,-0.19552976,0.00980383,0.73385763,-0.9996753,-0.733589,-0.47194418,-0.8978126,-0.17129965,-0.25363758,0.85783,0.5448468,0.13939649,0.17571731,0.16698042,0.3890213,-0.7995213,-0.06547106,0.0675202,0.9980824,0.5184827,-0.83279413,0.39272705,-0.3001056,0.22153176,0.37727872,0.8156128,0.83007294,-0.15176997,-0.6549391,-0.8443171,0.5474234,-0.27206725,-0.9997485,-0.48733723,0.31207633,0.46388978,0.11990431,0.121288,-0.29443172,0.19430874,-0.7731699,0.24756968,0.99959946,-0.37387264,-0.36857837,-0.668229,0.7712545,0.0249045,0.6555386,0.0459309,-0.40881205,-0.104019314,0.8163062,0.96517146,0.09847535,-0.8622698,0.034885023,0.5554675,0.29788074,-0.9502056,-0.62810355,0.29172957,-0.71451473,-0.5501522,-0.9966865,0.13622093,0.7792105,-0.3540684,0.06253834,-0.68017334,0.26209447,0.13517745,0.57973593,0.118472345,0.3937911,-0.44055757,-0.42637557,0.25285593,0.15416907,-0.3121832,0.18381101,0.97818893,0.07520838,0.31392127,-0.9764096,0.40909043,0.37941533,0.10990895,-0.08143759,-0.7548603,-0.0578842,-0.37982288,0.19587027,-0.06256431,-0.032233085,-0.35984993,0.52881354,0.22151497,-0.16962555,-0.10907149,-0.5604003,-0.07944467,-0.2802707,-0.701411,0.48506486,-0.8411236,-0.79696774,-0.18823682,0.18845572,-0.8629248,0.33482456,0.28463382,-0.546058,0.29165527,0.85924065,0.27068308,0.43445325,0.6902452,0.2871219,0.17696585,0.24476284,0.22828095,0.2482374,-0.41737902,-0.23785087,0.057748467,-0.76967305,-0.20485635,-0.770044,0.3831093,0.015741132,0.27467597,-0.043445785,-0.998219,0.013834848,0.5571006,-0.6285676,0.96682817,0.5530407,-0.045259453,-0.39777634,-0.07559086,-0.0939031,0.66956484,0.70397615,0.7499309,-0.06785455,0.38321784,-0.97527105,-0.18045333,-0.040301207,-0.23397677,-0.16749415,0.23539604,0.17021142,-0.52930516,0.5793676,0.4397542,-0.41692072,-0.6223718,0.04079721,0.3653384,-0.51643026,0.24496843,-0.9955917,-0.06175373,0.13524233,-0.04824764,-0.77537614,-0.407639,-0.034495886,0.90042853,-0.20784524,-0.41229197,0.6968206,-0.9974963,-0.11339167,-0.5005946,0.5397685,-0.6515212,0.19887738,0.09940572,-0.19870038,-0.5918965,0.101668015,0.6294894,0.08316652,-0.06100508,0.42041007,-0.26140708,0.16571508,0.44940645,-0.10637294,-0.6202364,-0.57041585,0.9988311,0.22164324,0.46126723,0.049833365,-0.8532375,0.20658211,0.8509123,0.44937906,-0.37861016,-0.4034035,0.99950886,0.2746374,-0.8103866,0.6899276,-0.050193314,-0.6231887,-0.89288294,-0.93480426,-0.19149898,0.09777847,0.99775964,-0.1619179,0.9275868,-0.2045252,-0.8142359,0.99898696,-0.49787402,0.9250857,0.17537071,-0.12125921,-0.5627157,0.3665576,-0.60971886,0.76632315,0.92029494,0.77514815,0.44812697,-0.46076733,0.084147654,-0.7105593,0.77651614,0.41747302,0.15764979,0.29855475,-0.16515777,-0.4789565,0.48401943,0.9256596,0.34887174,0.34960446,-0.46339443,0.77800053,0.43666193,-0.6119076,0.23520032,-0.68491197,-0.055251386,0.19588014,0.467651,0.66074985,0.40056664,0.52335596,-0.6299359,-0.023701409,-0.9198369,0.041109588,-0.0674974,-0.8777271,-0.048529748,0.114335544,0.2151233,0.04873442,-0.56545126,0.8362803,0.24925737,0.07294026,0.06349132,0.5821854,0.36447856,-0.97356784,-0.67241144,0.28007275,-0.45294747,-0.8230171,0.19150095,0.36827272,0.9992286,-0.24276854,0.11624617,0.5591978,-0.28932634,-0.68387973,-0.34532157,0.13428013,-0.02035692,0.6893343,0.64816844,-0.50092936,0.5634127,-0.5744773,-0.099144384,0.49442065,-0.7644397,-0.31475455,0.9999998,-0.5966187,0.55094093,-0.21744601,0.92733014,-0.72749376,-0.068415776,-0.5416877,0.5515785,-0.946439,0.004029933,-0.019886144,-0.2636827,-0.5119608,0.7582578,0.39044237,0.17299043,-0.6225011,0.009140599,0.54956186,-0.90010405,0.42559063,-0.088469766,0.9025106,0.74357355,0.54719394,-0.09562986,0.42803282,0.78040344,-0.77509934,0.113698296,0.5781265,-0.63679487,0.26548445,-0.107031934,0.21844432,0.2515875,-0.16795045,0.59630984,-0.27608493,-0.044840433,0.9665843,0.6301247,-0.96687025,0.25735775,0.9991421,-0.32642037,-0.2730683,-0.9593527,0.1519051,0.099266626,0.101750374,-0.14527176,0.33517602,-0.68636197,-0.11185821,0.7195081,-0.4872806,-0.8760568,-0.21870124,0.27298573,-0.42666107,0.31754357,-0.9999918,-0.9868088,-0.9807413,-0.23463176,0.19932325,-0.22531523,-0.7625392,-0.1884813,-0.7768519,0.5850339,0.73932546,-0.13092826,0.16065654,0.47053206,0.3991989,0.87556916,0.937077,0.6513699,0.31474832,-0.8589348,-0.9999805,-0.110682644,-0.011484564,0.1442336,-0.638741,0.4747907,-0.16577329,0.38013113,0.53920543,-0.15742964,-0.3764435,0.2556363,-0.53835946,0.9012126,0.4228576,0.1150328,0.25038183,0.073553264,0.16321634,-0.18352214,-0.23954752,-0.20417401,0.10739274,0.7712642,-0.9685446,-0.5234897,0.29674855,0.106845185,0.34470946,0.3941354,0.10647399,0.66294515,0.35286382,-0.2485802,0.38292316,0.5691074,-0.2760785,0.29225716,-0.470658,0.6902837,0.14631663,0.9997701,0.0724207,-0.33976752,0.11305683,-0.21166949,-0.17546871,-0.53752416,-0.98097944,0.39008126,-0.7253523,-0.70132065,-0.37039733,-0.08351966],
    [195,1,"Cc1oc(-c2ccccc2)nc1CCOc1cccc2c1ccn2CCC(=O)O",-0.48027918,0.44582316,-0.67212623,-0.31708443,0.039147884,-0.7289549,-0.22053616,0.31074613,0.021649754,0.43485105,-0.18538967,0.4044196,0.18026538,-0.23926473,-0.47599334,0.75900245,-0.6359943,0.47723374,0.2814649,-0.32604674,0.42584464,-0.04058705,-0.2813681,0.38332668,-0.73393995,-0.28020614,0.5914629,0.43285075,0.20143355,0.30541658,0.6338871,-0.07916419,0.023268268,-0.09670931,0.1592088,-0.5119057,-0.3280452,0.17815144,0.9996219,-0.60068333,-0.7968129,0.018560698,-0.2247292,-0.02951217,-0.48911393,0.6248369,-0.54119897,-0.18101533,0.29062897,-0.3236494,0.17466792,0.60383826,0.6731029,0.33216923,-0.079999745,-0.111214764,0.5925899,-0.69424784,-0.40936103,0.3355338,-0.2903691,0.75250983,-0.38704866,-0.2707675,-0.5443072,0.39511913,-0.15363504,-0.6281864,-0.44742414,0.43920204,-0.9788062,-0.44829965,-0.10594202,-0.8632074,0.2768783,0.32468918,-0.17412232,-0.22330639,-0.3071641,-0.99982387,0.1750254,0.09325777,-0.9703721,-0.4239693,0.64794475,-0.97166026,-0.49887648,0.68167585,-0.55071616,0.36513877,0.55878234,0.020739699,-0.7415059,0.58708507,0.9987141,-0.5632714,0.47225627,0.09746514,-0.25619835,0.3425506,0.33564174,0.7406888,-0.39706132,0.9921415,-0.99948,-0.54435086,-0.49753472,0.7241511,-0.9511445,-0.049298406,-0.67300653,0.47179282,0.6929258,-0.21086785,0.40811008,0.13084373,-0.08169158,0.40816405,0.79199916,0.62693024,-0.37514076,-0.43428004,-0.31695583,0.008245469,-0.6174642,-0.4827132,-0.17004463,-0.4034168,-0.12059029,0.9998272,-0.8221087,0.23595837,0.34477177,-0.31159967,0.2531733,-0.9882554,-0.6978947,-0.66601723,-0.032053635,-0.21374814,-0.9999992,-0.20046164,0.11720187,-0.7321653,-0.58016205,0.2957312,-0.027933054,0.25828305,-0.9945361,0.6111369,-0.17752953,-0.7364941,0.22845015,-0.54518366,-0.13276516,-0.45443362,-0.44959626,-0.9246738,-0.3135083,-0.92728734,-0.117669106,-0.31433985,-0.40531713,0.27134982,-0.26818064,-0.35267466,0.04466849,-0.6023605,-0.6727227,0.11819462,0.4253333,-0.52824014,0.2837169,-0.110309795,0.22846171,-0.8462755,-0.64518905,0.32595992,-0.5500843,-0.28566515,0.07674662,-0.9084343,0.7028108,-0.22391737,0.51400894,0.081491776,0.05590334,0.25820655,0.35334325,0.46298042,-0.6530546,0.24326207,-0.35564268,-0.060099874,0.028373491,0.061637286,0.116509564,-0.38926634,-0.10627108,0.47069076,0.83212954,-0.6561536,0.41252485,0.2190145,0.48592865,0.20668983,0.06091786,-0.59228706,0.02127188,-0.99997723,0.10563747,0.54578966,0.40555266,0.02761708,0.19917504,-0.80613834,-0.6527962,0.5210915,-0.16924989,0.76772964,-0.26065284,0.5685578,-0.27050552,-0.40370256,0.9708358,-0.17735335,-0.33334813,-0.294395,0.42374873,0.7388673,0.6369024,0.67943776,0.05778275,-0.35659954,0.46142042,0.68048245,0.6501205,0.3327002,-0.31309465,-0.7628998,0.9513267,0.18455715,-0.21559441,-0.43633974,0.47150734,-0.3244748,0.57142264,0.09926911,0.17388347,0.5346324,0.2939322,-0.025320346,0.029070739,-0.018899962,0.27946696,-0.11080692,-0.38758203,0.72769105,-0.080393754,0.35921225,0.708816,0.35045278,-0.088578224,0.32611206,0.10103189,0.40049714,-0.46081764,-0.06649358,0.9554745,-0.76120335,0.6340452,0.98721576,-0.5335447,0.55062646,0.8072315,0.5745445,0.20642598,-0.56676126,-0.44775787,0.12540965,0.12371078,0.9804102,-0.35417905,0.69956994,-0.32356215,0.7459681,-0.050060455,0.78218544,0.488119,0.5195122,0.36959732,-0.10588489,0.39329615,-0.6620802,-0.03715078,0.6090791,0.99999976,-0.9852769,0.31297332,0.4786337,-0.6367055,-0.5130555,-0.7017335,-0.5396062,0.49698997,-0.48989618,-0.998452,0.5181625,0.8490784,-0.29427457,0.34135202,-0.46570748,0.28067818,0.11446022,-0.058103632,-0.081776,0.18490437,-0.6270564,-0.97959423,-0.052076835,0.55061376,-0.03996199,-0.48105854,-0.63520133,0.024897575,0.7919267,0.37395468,-0.9104697,-0.13188604,0.51375324,0.38935,0.5243502,0.58704853,-0.17728283,-0.45115095,0.7805964,0.32905734,0.102195084,0.2772005,0.27021757,0.40134797,-0.40695578,0.6086435,0.11757894,0.40189725,0.29904646,0.75359225,0.3936835,0.42305115,-0.9637704,-0.7843649,0.34167397,-0.66831344,0.15872656,0.34790632,0.6812982,0.24792095,0.99914366,-0.31830472,-0.77981454,-0.65408474,-0.24667855,-0.08440949,0.5660935,-0.66786045,-0.5613692,-0.5467832,-0.40325004,0.55452406,-0.53120804,0.048628464,-0.5633075,0.18644014,-0.8204972,-0.36307025,-0.99999964,-0.4998902,-0.32453558,0.59425116,-0.16709104,0.33053365,-0.6996714,0.79652405,0.46599674,0.08811504,0.09564754,0.05177613,0.588358,-0.010083577,0.54697585,0.02175628,-0.6500161,-0.8024422,-0.5044042,0.4399951,0.13022514,0.6702604,-0.3198389,-0.77726185,0.009317761,0.89980215,0.2505824,0.46084765,-0.31359267,-0.54268223,0.48624432,-0.042470872,-0.7870593,-0.50009185,0.3493112,-0.25268227,-0.55246454,0.2729195,-0.67275345,-0.08388717,-0.004697898,0.9999501,0.25172406,-0.9785607,0.18037784,0.9895676,-0.19383174,0.29161754,-0.99909467,-0.2496056,-0.847927,-0.8410714,0.0584942,-0.43917045,-0.36441323,-0.52229434,-0.4401908,-0.45080453,-0.059783682,0.55705804,-0.5857768,0.011212327,-0.37348157,-0.99978966,1,0.77395564,0.76825124,-0.46493754,0.3412722,0.016827432,-0.26750654,0.59385353,0.08210668,0.67084146,0.2076306,-0.49211663,-0.49597275,0.24536623,-0.43060157,-0.3946222,-0.37417462,0.41740295,0.9703204,-0.99861294,-0.25583497,0.002774478,0.047733683,-0.40371734,0.5612731,-0.8171482,0.7301279,0.06953768,-0.5679959,-0.16736245,-0.09536306,-0.5807291,0.99451816,0.29635933,0.72198653,0.04698415,-0.20423263,0.12869468,-0.24732478,0.037503783,0.6373291,0.13589327,0.27024654,0.10417766,-0.0451604,-0.175822,0.42800578,0.111788526,0.28047147,-0.6502908,0.28258038,-0.17222494,-0.002046612,0.70464903,0.99961716,0.8527044,0.020006813,0.044065833,0.052055374,0.40993807,0.99997497,0.56127393,-0.67702717,-0.50141025,0.015140117,0.119279236,0.48562157,-0.99908435,0.21262829,0.742502,-0.60512495,0.15712799,0.657122],
    [196,1,"COc1ccc(O)c(C(C)(C)C)c1",-0.568716,-0.34487915,-0.08853985,0.12989704,0.32996327,0.07787192,-0.542152,-0.14875868,0.085267805,-0.532015,-0.59297204,0.378263,0.2864816,0.2559325,0.19511086,-0.3099373,-0.3225146,0.001756541,0.054364406,0.02817011,0.073955454,-0.65479267,0.59869945,0.043068632,0.08188115,0.51823187,0.119266786,0.5389366,0.28195116,-0.24645078,-0.46700886,0.44140208,-0.49233016,0.39766556,-0.2564949,0.44472605,0.20321907,0.37390685,0.63498,-0.8934527,-0.9961702,0.14235966,-0.16621305,-0.37338418,0.11589861,-0.99363196,0.13524261,0.07045107,0.9454302,0.5746922,0.50010765,0.13507642,-0.29903677,0.19822621,-0.9519996,-0.04824343,-0.62786764,0.8703536,0.27000085,0.038545918,-0.13643637,-0.48470578,0.53741676,-0.14906287,-0.029566912,0.2245724,0.43099493,0.530073,-0.11417813,0.52079064,0.56321263,-0.9711768,0.36410356,0.34597465,0.77929634,-0.21841455,-0.18063958,0.03513044,0.26188853,-0.9982729,-0.4206887,0.31183603,-0.7750958,-0.3573538,-0.23128912,-0.1829804,-0.2027361,-0.17165194,0.34020814,-0.33862647,-0.06092113,0.10657851,0.07868549,-0.2980994,0.6951964,-0.10927697,0.48444104,0.18918455,0.3008638,0.07212192,0.18344976,0.24223657,-0.18238275,-0.7182134,0.6898345,-0.07320438,0.03341926,0.23647048,-0.9266246,-0.31913725,-0.41844484,0.19458662,-0.14656602,-0.5197974,0.051448073,0.53555435,0.36099514,0.09812654,0.99951565,-0.18333957,0.26206255,0.3119943,0.20092335,0.33236495,-0.073708445,0.06721434,0.2718979,-0.32472837,-0.24544746,0.9994317,-0.22152351,-0.011029053,0.28710303,-0.061822277,-0.19312821,-0.8028451,0.42547527,0.6462687,-0.75136214,-0.30277142,-0.9991765,-0.026078979,0.9947958,0.7009796,-0.004433014,-0.08964915,0.0700513,-0.652176,0.9837623,-0.49382335,0.57280964,-0.7248963,-0.09736604,0.047076,0.036321893,0.11659306,-0.43992844,0.99762905,-0.7519266,-0.5401554,-0.99159503,0.008918935,-0.003837445,-0.13681088,0.007134808,-0.08022343,0.29942226,0.18593585,0.019768137,-0.084305786,-0.77290416,-0.41205052,0.3695743,-0.038152706,-0.07080592,-0.9706972,-0.75679547,0.43423638,-0.7236384,0.004674431,0.051405936,0.11521397,-0.5539996,0.3153636,-0.7702674,-0.3432017,0.54700905,0.46935463,-0.010215137,-0.63365644,0.80519116,0.2858289,0.332919,0.453012,-0.42477408,-0.14198364,0.28580818,-0.6519423,0.14652233,-0.32935506,-0.6656772,0.00068146,-0.2508394,-0.033837426,0.08474978,-0.36093104,0.23510213,-0.08967403,0.34194273,-0.979061,-0.5569523,-0.19080712,0.08589017,-0.06885168,0.49800172,0.33168527,-0.15138243,-0.025370114,-0.37296587,0.38767195,-0.3627837,-0.06345661,-0.0926182,-0.6267186,0.9932536,0.17612325,0.17594157,0.035024345,-0.004284817,-0.102729075,-0.41103205,-0.20850521,0.6186036,-0.27000314,-0.4446646,-0.44103774,-0.56038415,0.19118896,-0.39357516,0.10578965,0.9308687,0.54659635,-0.1177936,-0.6830191,0.28339937,0.07397829,0.026552236,0.32372335,-0.39519015,0.007822385,-0.30945238,-0.99845254,-0.3972268,0.32393944,0.2597425,-0.68938243,-0.40029895,0.1820904,-0.38700205,-0.004173697,-0.4564477,0.43094498,0.45849788,-0.4225981,0.7065697,-0.5386083,0.02330501,0.51713634,-0.27879316,0.5728376,-0.35945266,-0.08663182,0.38908848,0.004697407,-0.18227437,-0.65261006,-0.40481865,0.27520669,-0.053712677,-0.48046884,0.43745306,0.999674,-0.0922782,-0.17617565,-0.19280677,-0.054568436,0.05224774,0.084069185,0.6652806,-0.098462604,0.23480205,0.99936473,0.31683016,0.91971034,-0.18029243,-0.3199214,0.99883384,-0.97710586,0.10917663,0.06110197,-0.01489058,0.05899371,-0.2620342,-0.21519367,-0.13034518,-0.76735103,0.9847089,-0.19802293,-0.43347242,0.24279398,-0.28742823,0.32011274,0.2660066,0.15332687,0.861227,-0.54894197,-0.33490783,-0.19240594,-0.9610219,0.41340318,0.41799864,-0.13344899,0.8155638,-0.6580091,0.042866092,-0.12401323,0.21501432,-0.9500992,-0.15591247,0.52618706,-0.011237305,-0.533098,-0.18682668,-0.37779462,0.19965795,0.19632512,-0.310284,0.2409162,-0.2953196,-0.09565055,0.4294621,0.3279836,0.35268205,0.15537708,0.007945678,-0.07145891,-0.33955684,-0.60037714,0.043733887,0.85047424,-0.9952282,-0.22924162,-0.6910271,0.081428826,0.04165573,-0.38772312,0.3395845,0.9989242,0.003532876,-0.38514528,0.34069878,0.300061,-0.054671403,0.42693558,-0.7694843,-0.19646662,0.4150749,-0.09864319,-0.0898031,0.1563497,0.6156695,-0.015956407,0.5269367,0.8677325,-0.27695623,1,0.016746795,0.054628298,0.14080888,-0.16805528,-0.8400117,0.067197636,-0.39028266,-0.43592694,-0.76421934,-0.5863751,0.27100462,0.5847397,0.1007519,0.75141007,0.018120905,0.2540102,0.047893096,0.47270045,0.09840641,-0.66004,0.094966285,0.25181356,0.90242964,0.27769628,-0.94002265,0.32429513,0.12643021,0.2142677,-0.027418291,-0.16869004,-0.123128936,-0.48981985,-0.42387468,-0.3070912,-0.16116007,0.58015317,-0.45838642,0.11383748,0.2298875,0.055935074,0.99990994,-0.20648248,-0.9804789,-0.10169983,0.99973094,-0.26021135,-0.26909786,-0.99786,-0.38911182,0.6664159,0.6043424,-0.15879185,-0.6326234,-0.22983792,0.08803943,-0.025367035,-0.7577482,-0.63755155,-0.36450562,-0.4863852,-0.14558531,-0.08304458,-0.9999723,-0.998618,-0.99248797,-0.6892839,-0.18257865,-0.2135625,0.24123156,-0.5347934,-0.8059197,0.28684634,-0.4379076,-0.13297147,-0.6547124,-0.44720417,0.34401622,-0.08760224,0.7168672,0.060996454,-0.071545176,-0.97558326,-0.999967,-0.5610469,-0.09484415,-0.1540368,0.17584437,0.32143927,-0.98489374,0.39937714,-0.45610118,0.040724713,-0.27252498,0.10125341,-0.46571064,0.949989,0.13590439,0.76116335,-0.010627613,0.6131524,-0.48180127,-0.7500003,0.25740442,0.63124263,-0.6406719,-0.007997954,0.49843237,-0.5633656,-0.1858052,-0.14094959,0.2461422,-0.5071483,-0.35402185,0.5710408,0.037448954,0.028435169,0.32394713,-0.55779403,0.0775606,0.42014924,-0.116869986,0.15724003,0.60528487,0.99943835,0.41725683,-0.11923995,-0.4443529,0.43044192,0.08385993,-0.0351218,-0.19571666,-0.38366443,-0.109281,0.35438627,0.6559556,-0.20398979],
    [197,1,"CSC1=NC(C)(c2ccccc2)C(=O)N1Nc1ccccc1",0.3250268,-0.20041183,-0.122003146,-0.77393734,0.13884035,-0.6364539,-0.34218678,0.69655836,0.08454779,-0.67635286,-0.016414411,-0.2234438,0.097817086,-0.7649776,-0.24806058,0.1305344,-0.3798736,0.39861098,0.18168499,-0.043362178,0.50074446,-0.072768785,0.52767193,-0.09905029,0.5066037,-0.012612216,0.27724364,-0.08889802,0.29779604,0.5639334,0.093919024,-0.36845127,-0.2547587,0.34757185,-0.4507212,-0.18021299,0.566408,-0.14891198,0.9982866,-0.8040844,-0.93570375,-0.4463047,0.20351972,0.41833472,0.083695084,-0.63584405,-0.020020979,0.36094496,0.7745959,0.6664755,-0.76397634,0.059573416,0.14743173,-0.23831472,-0.37518278,0.5689098,-0.65939647,-0.2435835,0.002119597,-0.36485067,0.12237494,0.6078255,0.10505602,0.35990524,-0.19544351,0.016516339,0.03292985,0.68263566,-0.032535464,0.25039878,-0.33661535,-0.9601674,0.08633849,0.24096243,0.5249073,-0.8352404,0.27171358,-0.41572833,-0.22932468,-0.9981463,-0.5446675,0.53745955,-0.8452073,-0.5505706,-0.30262655,-0.6708007,-0.04122822,-0.29227072,-0.10210133,-0.65108263,-0.29306105,-0.14508261,0.50760216,0.3573732,0.9935956,0.049236923,0.26593134,-0.015745537,0.11237493,-0.24779683,0.312265,0.2751225,0.5162896,0.9004759,-0.9854307,-0.6155689,0.07453963,-0.20990984,-0.72423536,-0.538433,-0.01917112,-0.09832755,-0.27624863,-0.13187055,0.038697403,0.44143754,-0.09468526,-0.2205596,0.99393153,-0.7741463,-0.015879504,-0.8136275,0.57269526,-0.10220511,0.07495799,-0.5220559,0.18875468,0.42168927,-0.42747653,0.99942905,-0.09794127,-0.27793378,0.3590531,0.020353619,0.4227634,-0.98813945,-0.4428107,0.58171177,-0.51699835,0.031105384,-0.99999833,0.32464248,0.8623045,-0.28272218,-0.049561225,0.6826007,0.14200643,-0.22856408,-0.7946841,-0.16620357,0.35835892,0.23994292,0.18848503,-0.3249832,0.46973342,-0.20624088,0.4069278,0.60457134,-0.6938977,0.044978872,-0.86249644,-0.4368242,-0.24993509,0.5634727,-0.35861722,0.7171049,0.45809403,0.55197173,-0.518733,-0.17207766,-0.34270996,-0.6495683,0.31092775,0.50456977,-0.38293758,-0.74208736,-0.6120167,0.17611055,-0.6415396,-0.547649,-0.033944298,-0.67882246,-0.51193863,-0.21971612,0.09285556,-0.6300622,0.8754118,-0.7364213,0.20912589,-0.6595929,-0.36780015,-0.44696715,0.7290787,0.10167926,0.5148027,-0.7235513,-0.6618204,-0.71571606,0.49435133,0.38843325,0.70811653,-0.19261885,-0.014488344,-0.19463967,0.1973096,-0.38611853,-0.4805609,-0.025852786,0.40532392,-0.9998701,-0.47534987,-0.18592447,-0.30185455,0.45274758,0.48875412,-0.4326168,-0.20448588,-0.5486264,0.4220016,0.6837673,-0.15707622,0.26995578,-0.48961705,-0.17180702,-0.9736255,-0.18995683,0.36745444,-0.17661236,-0.10582184,0.031018445,-0.49512827,0.25695682,0.8322006,-0.22797436,0.01584713,-0.07773561,-0.4453194,0.33464333,-0.05248349,0.07587494,0.7887698,0.3062752,-0.34908438,-0.08080004,0.28897434,0.63438183,-0.60763544,-0.08711877,-0.13500176,-0.6279635,-0.41352418,-0.69401157,-0.19631019,-0.28994933,-0.05443139,-0.51708436,-0.46903515,0.23000649,0.4871393,-0.46660373,0.012158795,0.37875924,0.24567226,0.005398809,0.08247014,0.36279917,0.26955885,-0.4330163,0.33069053,-0.09921935,-0.6711442,0.9954648,-0.639338,0.14886749,-0.357208,-0.520486,0.10276179,-0.2043386,-0.06457482,0.21497616,0.16866864,0.99840087,-0.32976264,-0.5101507,0.32747462,-0.2292864,0.4096387,0.3164436,-0.7626107,0.04833602,0.07570609,0.97420436,0.20173648,0.36823264,0.64219284,0.28960323,0.99999976,-0.9716156,0.07011838,0.44063753,-0.61919695,-0.6603409,0.25187337,-0.3724536,0.2922215,0.8200923,-0.7260461,0.3987324,0.46147,-0.14789768,0.32617772,0.12808016,0.5754487,-0.16930462,0.5570094,0.023188464,0.09075284,0.11256686,-0.96814823,0.4593616,-0.6070259,0.40547237,0.47794482,-0.019322684,-0.23535562,-0.49335915,-0.8782966,-0.6316244,0.19017678,-0.11724089,0.1377247,0.6153961,0.43662134,0.19828498,0.8813949,0.27367187,-0.33308113,-0.2940195,-0.32260817,-0.13612166,-0.30696085,0.28473917,0.45171827,0.62181044,0.2669596,0.12330751,0.28403112,0.8215913,-0.43675074,-0.7274821,-0.9551539,-0.3420368,0.5525401,0.10319994,-0.26801777,0.0312023,0.27809983,0.999795,-0.050362892,0.05681892,0.36834595,0.27043104,-0.5346462,-0.07236564,-0.82433313,-0.34654683,-0.5329628,0.28922027,-0.83016175,0.16341011,0.06626259,-0.18048485,0.5221312,-0.48693258,0.38795376,-0.99030626,0.11041677,-0.16196007,-0.2056596,0.092839204,-0.49106765,-0.28453818,-0.005929423,0.1427694,-0.26169863,-0.052695204,-0.20180432,0.64757544,0.3695199,-0.36876637,0.49068484,-0.43892497,0.1371492,0.33772555,-0.29610306,-0.30510595,-0.10711968,-0.4689898,0.34465995,-0.13083917,0.195691,0.35071582,0.3380574,0.24660484,-0.33210355,-0.62450814,-0.7422245,-0.010795797,-0.32236165,-0.20942152,0.2774855,0.2663537,0.8380125,-0.15763038,-0.5336892,-0.5764438,0.9999503,-0.2000294,-0.9356047,0.5273341,0.9993559,-0.38091618,-0.47783583,-0.9985025,-0.11612277,-0.586209,0.53792465,0.8212496,-0.24823865,0.124099344,0.015280569,0.25454682,-0.4166352,-0.8454346,-0.34279084,0.07686181,0.14476457,-0.23798421,-0.99997914,0.9999993,-0.6852933,-0.04645038,0.44298893,-0.32135296,0.17550261,-0.15873326,-0.6509437,0.78255206,0.1585179,0.37595075,0.01037589,-0.39417475,0.23021096,-0.6501571,-0.3661693,0.036755282,-0.16312857,0.26995152,-0.9998811,0.007786626,0.18754004,-0.29956418,-0.14236504,-0.34037286,-0.8806084,-0.21584421,0.24184513,0.38202718,0.07203509,0.43025708,0.53669935,0.8651992,0.1355014,0.49017552,-0.06348137,0.18795069,0.42427537,-0.47507808,-0.17390552,-0.107700594,0.46127632,-0.3369301,-0.99584574,0.3677997,0.36277303,-0.5522437,-0.48498496,-0.05321198,-0.36542928,-0.114362136,0.2321637,-0.36187723,0.5362786,0.9855785,0.6183737,0.17295605,-0.65640867,-0.54799503,-0.19887665,0.99991906,0.39225414,-0.23942204,0.16762342,-0.12127762,0.33615828,-0.44123185,-0.99193203,-0.16227686,0.28398284,-0.7086581,0.26184326,0.39854106],
    [198,1,"CCC(c1ccc(O)cc1)C(CC)c1ccc(O)cc1",-0.7810634,0.14167972,0.12295179,-0.019024324,0.5170244,-0.078183,-0.54836804,0.24572328,-0.074755765,-0.41452125,-0.9052068,-0.35762182,-0.26224387,-0.80721116,0.34993237,0.22889143,-0.5945803,0.082300335,-0.15253074,-0.25552735,0.13378835,-0.5936775,0.50148684,0.004504821,-0.23462373,0.46909928,0.09866452,-0.21778665,0.7735606,-0.24530181,-0.4951803,-0.37607858,-0.4190391,0.08375048,-0.19287807,-0.54347795,0.41909578,0.18833247,0.9930129,-0.7608408,-0.70399225,-0.1067921,-0.57696617,0.3038631,0.16472794,-0.87864,0.7663836,-0.16587141,0.9015602,0.2823198,0.3818641,0.20573254,-0.57516146,0.61384994,-0.9082799,0.037778664,-0.5097559,0.48632464,0.30916354,0.65059334,-0.6280317,-0.15518647,0.2890388,-0.49233449,-0.26571825,0.22331417,-0.7860943,0.36318454,-0.18195531,0.031528067,0.109709546,-0.098163776,0.087118074,0.11085241,0.8719921,-0.08636791,-0.39203805,-0.28888875,-0.24513927,-0.99685663,-0.88155687,0.22071037,-0.87307495,-0.01530869,0.005607503,-0.9401549,-0.53126633,0.07513266,-0.23225088,-0.50081724,0.6744172,0.6071049,-0.26467836,0.06509217,0.6775155,-0.5430484,0.8257846,-0.08952445,0.20630826,0.121253125,-0.2111964,0.39524844,-0.3157616,0.8971263,-0.93765914,0.47517535,0.14665855,0.3243739,-0.99934024,-0.33593908,-0.6659529,-0.021004975,-0.23535427,0.045274287,-0.17799616,0.45735922,-0.08594014,0.49990368,0.99465406,0.43434873,-0.35343108,-0.053336322,-0.70694697,0.43909657,-0.6706976,-0.15238562,0.38595587,0.058498982,0.26998794,0.99995166,-0.11069925,0.3481966,-0.48574567,0.05229692,-0.48140258,-0.78509027,0.44091797,0.88464665,-0.7674618,-0.5791386,-0.99992126,0.38099512,0.9829915,-0.018958785,-0.007883325,-0.51832956,-0.18484014,-0.39967698,-0.26642978,0.16625826,0.22870658,-0.9112657,0.82249695,-0.025965223,0.3595653,0.45077512,-0.42665166,0.7463847,-0.7973465,0.046152286,-0.93496925,-0.08330102,-0.45777747,-0.29306665,0.035800356,0.49844062,0.85713506,-0.4520105,-0.40748453,-0.6546565,0.09939625,-0.032843295,0.43061528,0.27386597,-0.3326061,-0.9774812,-0.8883621,0.24848905,-0.40534896,-0.57544076,-0.10097878,0.2051568,-0.3099261,0.7829902,0.19453707,0.17205799,-0.035922065,0.26273268,-0.34644327,-0.241631,-0.08764999,-0.017894443,0.48231786,0.51391274,-0.26311377,-0.46644688,-0.19167031,0.66345,0.3741423,0.5972857,-0.37252536,-0.21793774,0.54434186,0.09014001,0.20614053,-0.25713047,0.57118946,-0.22539541,0.35897988,-0.9997893,0.07691105,0.66748655,0.62393165,-0.20850651,0.50140417,-0.26083583,-0.7276189,0.497832,-0.63695663,0.048898563,0.1646228,-0.026371233,-0.5376832,-0.38277522,0.9999116,-0.16582964,-0.26582202,0.20099239,0.4428022,-0.042355027,-0.6593023,-0.8229189,0.58927155,-0.08633707,0.56259584,-0.22196192,-0.09177364,-0.6274916,0.18870509,0.49997783,0.80796456,0.7503237,0.58288443,-0.53903675,0.082305714,0.56711024,0.5430831,-0.097463585,-0.7575407,0.16174936,-0.34781817,-0.9747987,-0.5303168,0.7070093,0.60613847,0.08439652,-0.5589894,-0.09616267,0.27712014,0.33451024,-0.46095765,0.49860728,-0.21429892,-0.29752165,0.17964567,0.10557818,0.31400508,0.42073685,-0.790866,0.33586508,-0.7163768,0.9803022,-0.11715987,0.10435116,0.53039736,-0.51256704,-0.13408795,-0.45768568,-0.22024837,0.3506868,0.63729775,0.9986576,0.21692966,0.34489542,-0.25618735,0.18470916,0.29910323,0.31029037,-0.1078199,0.08088477,0.15545799,0.98177946,-0.13059439,0.28037572,-0.47054124,-0.81872755,0.9999731,-0.99815726,-0.2128184,0.563909,0.4864186,-0.41991323,-0.57889795,0.37143025,-0.0909815,-0.98418266,-0.5755765,-0.11746844,0.55448556,0.2878656,-0.29630288,-0.58547515,0.5049236,-0.41773635,0.82752913,-0.7232044,-0.7140437,-0.06252254,0.97608924,0.4271873,-0.2978975,0.11355213,0.5240692,-0.80939704,-0.5165601,-0.5277316,0.42357457,-0.9375944,0.055313073,0.261972,0.276981,-0.15528865,-0.124644876,-0.12267268,-0.32846668,0.91783905,0.040767044,-0.34857407,0.060390614,0.05687555,-0.60587937,0.58941865,0.3832244,0.33968118,0.076024175,-0.099080205,-0.5704693,-0.7055463,-0.268086,-0.27014762,-0.9768232,0.26069126,-0.54444784,0.4632858,0.065301426,0.12999097,0.27545616,0.99988335,-0.25781256,0.23328446,0.023520298,-0.32996967,-0.09754817,0.5188994,-0.93749917,-0.30270728,-0.36019433,0.07222424,0.028872794,0.8408688,0.31459546,0.28708842,0.041749563,0.67315125,0.68032986,0.9940808,0.6818783,0.1420456,0.44940406,0.29917896,-0.58828413,0.44083357,-0.47039706,-0.71803486,-0.35902232,-0.23599379,0.36288187,0.40803954,0.2669258,0.21657617,-0.38356054,0.6613509,0.1540874,-0.28147623,0.12191361,-0.5113204,-0.72930557,-0.9271424,0.5801554,-0.4206536,-0.8597323,0.45843023,-0.22181877,0.14056084,-0.21479098,0.10057917,0.063305005,-0.6725608,-0.3868355,-0.15930645,0.2625682,0.47493905,-0.579546,-0.045498062,0.39791813,-0.48390606,0.8679044,0.21484925,-0.9620921,0.1686606,0.99925166,-0.036036946,-0.21870731,-0.9830412,0.29944688,0.12661533,0.5512696,0.031446923,-0.45094955,0.7273289,-0.85424775,-0.88381976,-0.06177435,-0.08623679,-0.26452294,0.26422626,0.51604044,-0.055092458,-0.9999584,0.9940246,-0.72037584,0.2911966,0.20786084,0.50281227,0.28231093,-0.8149483,-0.2083719,-0.4710412,-0.12329174,-0.37333682,-0.75035673,-0.32173374,-0.4340602,-0.44009894,-0.04269755,-0.49648395,-0.008607911,-0.17061782,-0.99988276,-0.6798458,-0.5233739,-0.46807432,0.6782203,-0.330295,-0.9913765,0.007859433,-0.75513333,-0.100700386,-0.65905225,0.12441545,-0.64471626,0.94892263,0.099002406,-0.6352616,0.30588388,0.75502205,0.003985995,-0.91568327,-0.5442911,-0.40464765,-0.4737252,-0.517995,-0.9332671,-0.19236363,-0.08519485,-0.22154117,-0.13054858,-0.7240219,0.035042197,0.5448305,-0.52187353,-0.026603024,0.38270193,0.9703307,-0.119673125,-0.5173922,0.33204374,0.10643091,0.19501263,0.9998977,0.5096575,-0.5966535,-0.2593798,0.5004236,0.5682719,-0.37362215,-0.98451453,-0.2616166,0.8453789,-0.17990203,0.47009328,-0.2964121],
    [199,1,"O=C1C2(Cl)C3(Cl)C4(Cl)C(Cl)(Cl)C5(Cl)C3(Cl)C1(Cl)C5(Cl)C24Cl",0.43080536,-0.6666778,-0.22850844,0.34939498,0.09497069,-0.8234679,-0.4613551,-0.08456269,0.44162604,-0.95001155,-0.14860529,-0.13261402,-0.34460247,0.6607667,0.44278768,-0.9801999,-0.55561686,-0.074473575,0.49289012,-0.089396186,0.19122933,0.022679059,0.65305483,-0.42363802,0.4277433,0.7152934,-0.6669908,0.4652257,0.9830311,-0.42354932,-0.4839304,0.45693764,0.26775205,-0.21393615,0.69067454,0.04289506,0.44808623,-0.13377194,0.9998032,-0.78641945,0.112159856,0.60748094,0.60414875,-0.4944503,0.61528754,0.3001948,0.5924366,0.21061303,0.9993173,-0.6880327,-0.8603915,0.47359723,-0.39129633,-0.36001587,-0.92931855,0.31708702,-0.86199754,-0.95949507,-0.3834572,0.23233575,0.33346146,-0.31255764,-0.05123365,0.22043109,0.46566728,0.7970129,-0.16126971,-0.60548145,0.6766881,-0.1415813,0.8594854,0.33967313,0.88873917,0.93502766,0.7423649,-0.8321822,0.7057509,-0.2692735,-0.31741363,-0.9917361,-0.680972,-0.38291124,-0.5634848,0.6274505,0.8016641,-0.8116195,0.6501216,0.16830523,-0.54547906,0.65199196,-0.7168221,0.40882224,0.6235632,0.2739484,0.87607574,-0.3036085,0.8333161,0.032109875,0.49864325,-0.5928245,0.80190593,-0.27559862,0.9522815,-0.42847747,-0.9995821,0.91747725,-0.6331301,0.2510377,0.98759574,-0.40043432,0.30881104,-0.004510328,0.104341336,-0.62785184,0.09032774,0.09881536,0.3329612,0.93420404,0.9848422,-0.4467929,0.6681299,-0.2577076,-0.5631566,-0.5539186,0.8386089,0.010947733,0.8777746,0.5057545,-0.55991185,0.9996923,-0.3548682,-0.16955167,0.91828203,-0.11957917,0.9570494,-0.7544423,0.9034538,0.2619308,0.80739534,-0.61809325,-0.9997791,-0.42894652,0.92184603,0.44547153,0.56590855,-0.12295052,0.44777155,0.18496723,-0.99665827,-0.42078328,-0.61349636,-0.80481577,0.7435112,-0.7269017,-0.7877571,0.39696315,-0.24102116,-0.7184365,-0.9625639,-0.8682623,-0.12579979,-0.14144985,0.4819693,0.34051812,0.8374727,0.73314154,0.3203652,0.3726225,-0.72304136,-0.24947417,-0.9848447,0.18181494,-0.81264746,0.5113462,-0.22150661,-0.83045965,-0.6178439,0.7759348,0.85333836,-0.5953304,-0.2012115,0.4816941,0.6618909,-0.81680125,0.8842076,-0.6717832,0.058085553,0.41768882,-0.5468195,-0.6814538,0.7326453,0.65686387,0.37319303,-0.8846901,-0.6591659,0.62919456,0.113032594,-0.4178627,0.19659147,0.10844937,-0.66119516,0.7976123,-0.39223275,-0.37151104,-0.29402798,-0.706408,-0.4709953,-0.17710847,0.5408073,-0.9998881,-0.70144856,0.5701495,0.3378007,-0.24426965,0.3935617,0.15657037,0.17816652,-0.9194393,0.4767632,0.021308402,0.112968214,-0.6853566,-0.08567877,0.64490086,-0.98336875,0.13123144,0.7991122,0.442135,-0.02093141,-0.4987206,-0.5073657,-0.3805753,-0.44302428,-0.7106742,-0.39067665,-0.18363152,-0.042093042,-0.31558704,-0.7220629,-0.61380196,0.28694108,0.7511882,0.30802846,0.19762404,-0.9268822,0.40603727,0.39353144,-0.66725516,-0.5632108,-0.8608896,-0.07747171,-0.076399945,0.14188054,-0.4814359,-0.7144474,-0.7957939,0.5237607,-0.3561226,-0.5254032,0.42812744,-0.42790797,0.6593502,0.40984684,-0.79895735,0.6533242,-0.018992268,0.3452666,-0.90508705,0.965677,0.72103405,-0.7115873,0.9999725,-0.14151104,-0.8532732,-0.19006856,0.77516395,-0.40005523,-0.84853697,-0.03417399,-0.9800011,0.6436424,0.98316294,0.7864892,-0.1141397,-0.078725934,-0.5850487,-0.70654637,0.9213799,0.33082047,-0.58325434,-0.79119587,0.6375593,-0.11071729,0.7976279,0.7255409,0.29033712,0.99999547,-0.99348354,0.3109921,0.51423895,0.5607717,-0.14051683,0.8989503,0.6488673,-0.693247,-0.94741374,-0.9486493,0.6535905,-0.83725405,-0.3505965,0.41495174,-0.36137807,0.8078547,-0.22709885,0.8550863,-0.8262315,-0.531323,0.38938776,-0.99927884,-0.49816984,-0.24963544,0.5761229,0.9489323,0.6449066,-0.38321483,-0.8770231,-0.6439396,-0.7981653,0.53960866,0.5688303,-0.6608202,-0.430611,0.26987508,0.59320736,0.80575395,0.9133499,-0.5262048,-0.23019294,-0.3488347,-0.39403442,-0.39560437,-0.94317377,0.62058425,-0.964689,-0.012841968,0.6112309,-0.35393292,0.11552371,-0.17535613,-0.9188136,-0.46707743,-0.5389234,0.79757565,-0.35852775,0.8812496,-0.32606703,-0.49814516,0.99933016,-0.025003305,0.4039358,-0.1943189,-0.024107056,0.82914245,-0.15255144,-0.9672449,-0.41338804,0.85062534,0.99389625,-0.091544285,-0.5274684,-0.3308629,0.61924094,0.937466,-0.45655808,0.01799644,-0.9999999,0.7047209,-0.73890454,0.053771436,-0.55612755,-0.9286432,-0.004618222,-0.70370394,0.3673006,-0.75113565,0.29499394,-0.67317075,0.7812244,0.33665845,-0.6165192,0.72686076,-0.22612631,-0.20192043,0.042739443,0.38750398,-0.22328027,-0.25376895,-0.83567333,0.97658074,-0.89590675,0.066342734,-0.4837834,-0.79665786,0.81573653,0.37259564,0.019765694,-0.5333766,-0.27932894,0.074759915,0.6669169,0.7656703,-0.350561,0.015789924,0.68995833,0.25487182,0.27152586,0.9999932,-0.2463346,-0.8389546,0.67701715,0.99068165,-0.7841347,-0.55011183,-0.9997544,-0.06476081,0.39251196,0.3303072,0.08550311,-0.3846794,-0.7825524,0.002776023,-0.87519586,-0.12853485,0.7415982,-0.18779722,0.688349,-0.50436586,0.35532957,-0.9999954,1,-0.6939187,0.62091094,-0.03740323,0.9158314,0.45875648,-0.40153316,-0.8839155,0.5800419,-0.57921296,0.673727,0.16351695,-0.1440278,0.43945238,0.42289126,-0.41002077,0.4633874,-0.9360916,0.83109015,-0.9997606,0.40432477,0.39633822,0.7792844,-0.22691159,0.20725937,-0.96371114,-0.45871198,0.04681672,0.6339281,0.7912623,-0.4314663,0.22128245,-0.87990904,-0.83298355,-0.55386937,-0.036000285,0.08275285,0.6230532,0.5173014,-0.7286927,0.4564984,-0.83426946,-0.94991356,-0.99997765,0.33171055,0.09402245,-0.40529147,0.582219,0.6226767,-0.7326004,-0.35026368,-0.10898309,0.23874812,0.10660486,0.99457306,-0.25512967,0.31378204,-0.7414589,-0.22552551,-0.26584473,0.9993301,0.6041803,-0.14512856,-0.11870423,-0.25905225,0.6092279,0.7547969,-0.9990966,-0.76451975,0.103871904,0.97212565,0.8800927,-0.3199997],
    [200,1,"CC(C)(C)c1ccc(CSc2cnn(C(C)(C)C)c(=O)c2Cl)cc1",-0.26737028,-0.76269263,0.6265293,0.67698103,-0.18234499,-0.66616774,-0.1789058,0.30607554,-0.069370694,-0.6554274,-0.49426562,-0.35894105,-0.2062543,0.2110922,-0.17445107,-0.77400297,-0.26776633,-0.7758969,0.7173701,-0.5208109,0.29542983,0.061780397,0.2793722,-0.63817704,-0.12850024,0.28608647,0.22870718,-0.37869975,0.22340776,-0.7803167,-0.70941633,0.5230989,0.6477781,-0.51092595,-0.107410036,0.8707437,-0.28715247,0.41279078,0.9989432,-0.7658045,-0.9594505,0.15593152,-0.32120076,-0.09960388,-0.7785444,0.023675602,-0.67340153,-0.14630441,0.90609425,-0.23142841,0.80139756,0.46812198,-0.7095228,-0.019502088,-0.5931817,0.12551819,-0.36371014,-0.7010208,-0.12464686,-0.79458946,0.38275245,-0.10798474,0.67718405,0.8389082,0.43098423,-0.058959626,-0.43500757,0.16010925,0.49895653,-0.2638699,-0.6883736,-0.46087673,0.114509515,-0.62797827,0.89310056,-0.73519874,0.42261437,-0.4286554,0.5035307,-0.9996787,0.24395297,0.19641282,-0.7970435,-0.7504781,-0.12735331,-0.97477543,-0.20420636,-0.5835364,0.1472031,0.8322612,-0.28522444,0.53494257,0.1199499,0.23425864,0.9724362,-0.80534154,0.8295628,0.3180709,0.2520788,-0.29999542,0.66200936,0.272408,0.13451074,0.8828765,-0.9964788,-0.71928895,-0.7549353,0.6638466,0.97685444,0.27658275,-0.20808089,0.13934751,-0.5036563,-0.34529537,-0.81376785,0.3626654,0.74690574,-0.4819549,0.97373414,-0.44888347,0.63279015,0.33557191,-0.29998517,0.67597693,-0.13900541,0.40587223,0.10471939,-0.14536226,0.68251926,0.9998992,-0.27387863,0.4509522,0.67624164,0.19738927,-0.41196445,-0.9921256,-0.096834205,0.50357556,-0.6838436,-0.3119467,-0.9999519,0.1134485,0.88645416,0.12058307,-0.64075917,0.41339532,-0.32816294,-0.31084576,-0.937016,0.05867704,-0.64914066,-0.5739866,-0.27856636,0.3769708,0.5113129,0.6121712,-0.41160497,-0.2173704,-0.91916776,-0.9012538,-0.546886,0.44489324,0.43996775,0.31063586,0.7413528,-0.21464553,0.7150301,0.18634158,0.72317564,0.53611726,-0.5113786,0.06586377,-0.38564652,0.59316623,-0.36344787,0.38275215,-0.68334496,0.06470028,-0.36471605,-0.024129521,-0.88870406,-0.22302653,-0.49784204,0.5066623,-0.18055207,0.38221842,0.5630568,0.03565489,0.24284738,-0.2593138,-0.5814001,0.55794936,-0.10559416,0.43002442,-0.18265145,-0.048408955,0.8157684,-0.7580362,0.48157495,-0.55249166,-0.6707355,-0.5997158,0.4945106,-0.08225294,-0.41580588,-0.12926883,-0.33678114,-0.83159447,-0.17128722,-0.9998282,-0.14302213,0.30629143,-0.04381558,0.055100925,0.6440164,0.11717726,0.53724647,0.25730953,-0.48036286,0.47237194,-0.1261313,-0.7240233,0.600786,0.047802515,-0.98340327,0.61613566,0.19871499,-0.42499077,-0.44294992,0.35803413,-0.2596143,0.26759455,-0.09259737,-0.16435258,-0.27356538,-0.19819388,-0.07961309,0.07893691,-0.58833027,0.29652232,0.93260306,0.5141134,-0.39629182,0.20773195,0.35088095,0.35947526,-0.16462548,-0.4646349,-0.26660326,0.11061169,0.32737416,-0.9658743,-0.072664015,0.69954467,-0.48023468,-0.42052,0.12229011,0.29374662,-0.11667922,0.1965773,-0.23761113,0.45690426,-0.5184178,-0.18960218,0.38103336,-0.37188986,0.07007538,0.15471806,0.87108827,0.4405771,-0.04877609,0.99289316,0.3557917,-0.4379706,-0.92366284,-0.46029395,0.31662455,-0.6519977,-0.2786396,-0.73651147,0.49589887,0.9953905,0.22690694,-0.2621057,-0.5108232,-0.02543747,-0.022530314,0.9577025,0.88826454,-0.02655135,-0.1862671,0.8378126,-0.09768944,0.32561067,0.23447981,-0.050743345,0.99997365,-0.99585336,0.4195799,-0.15515582,-0.23394972,-0.33421278,-0.60170233,-0.6744338,0.6277733,0.12310169,-0.95496005,0.5140442,0.814999,0.47709766,0.42764777,0.27676007,-0.79010797,0.004991617,0.70297885,-0.32678723,0.32197785,-0.06931629,-0.9999403,0.18038605,-0.12077845,-0.53453386,0.65692663,-0.14347222,0.009610086,-0.2767485,0.41333324,-0.9175466,0.20718446,0.26079106,-0.057799317,-0.6347982,0.54510576,0.017073728,0.35584107,0.85368246,-0.19408925,0.51514834,0.26775473,0.2913368,-0.50727147,-0.5336669,0.49771196,-0.28598985,-0.13915735,-0.012684163,-0.74310786,0.027112592,-0.6376223,-0.89157635,-0.89245385,-0.60523516,-0.6540069,-0.27569157,0.26809064,-0.54122126,0.3360661,0.99933565,-0.50984675,-0.18854256,0.069481544,0.0668435,0.42352363,-0.22552244,-0.71902806,0.07655712,0.24145964,-0.12562153,0.4321687,0.29489958,-0.032647472,-0.0344759,0.21219859,-0.39366108,0.11404665,0.9850365,0.004273279,-0.82034385,-0.48603126,-0.059003998,0.3009681,-0.23520346,0.3555927,-0.6471649,0.21530926,0.3872793,0.7872384,0.62131417,-0.66307163,0.6323769,-0.1515716,-0.6166385,-0.030936366,0.5943789,0.110242724,-0.2667251,-0.81239706,-0.6564305,-0.52247846,-0.5558448,0.13930558,0.43576846,0.031489767,0.20347802,0.5350513,-0.33619133,-0.81907153,-0.77886444,0.23467305,0.6457924,0.23750599,0.6721926,-0.17889191,0.741791,-0.61709666,0.18485063,0.9999996,0.53416896,-0.98454,-0.18933791,0.9991633,-0.5934528,0.4230227,-0.99996686,0.36122844,-0.8727947,0.046700004,-0.525606,-0.2121156,-0.07056823,-0.061968796,-0.8034265,-0.19873899,-0.013553736,0.27942586,0.46524385,0.2778975,0.3682422,-0.9999709,0.99864113,-0.13669527,-0.1718169,-0.7165354,-0.39086944,-0.03539513,-0.31674653,-0.37376648,0.16625233,0.41937396,0.46797848,0.07697686,-0.25043014,0.6333495,-0.2379254,0.5428792,-0.31724015,0.17268555,0.8238407,-0.9997462,0.2144127,0.026682349,-0.11811573,0.1278545,0.114352964,-0.9707746,0.7465122,-0.50135875,-0.1656924,-0.50082564,0.02522114,-0.5446613,0.9669499,0.12604745,0.5553607,-0.012092635,0.22925524,0.1684466,-0.021770187,0.38122818,0.19259338,0.32012215,-0.6785399,-0.20242856,0.27877307,0.71743625,-0.6572278,0.33979815,0.06137545,-0.067269415,0.6782803,0.599423,-0.09214906,-0.18201563,0.99410355,0.898595,0.051790632,0.33682933,-0.003105479,0.628711,0.99989176,0.8083247,0.39913565,0.43992132,0.045000993,-0.34289432,-0.7150047,-0.99394107,-0.49568573,0.64771086,0.5896692,0.41992244,-0.2971408],
    [201,1,"O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O",-0.70493704,-0.5904139,-0.13030307,-0.4132348,-0.22998112,-0.34116805,-0.646909,0.4868672,0.6137666,-0.12913449,-0.383756,0.32621068,-0.11552089,0.2843036,0.21729378,-0.4414683,0.012116281,0.2993569,0.47021446,0.39672735,0.52070683,-0.49299634,0.48305842,0.5535845,-0.38510662,0.038697913,0.021726595,-0.011915846,0.22725296,-0.6577885,0.00453482,0.1585727,-0.5025449,0.13543902,0.40917605,-0.4131925,0.2730148,0.6869919,0.99540126,-0.680257,-0.97988075,0.38246438,0.02075851,0.17372254,0.13639747,-0.8175568,0.36099142,-0.13193831,0.5362036,-0.086099334,0.4588175,0.123895295,-0.16855463,-0.23601675,-0.594538,0.20104901,-0.8092463,-0.04043333,-0.20082957,0.59184587,-0.19276878,-0.04579146,-0.22934797,-0.34455767,-0.40547574,0.7138976,0.1909271,0.23450989,-0.11239247,-0.23401076,-0.91627294,-0.9077798,0.46861675,-0.6775095,0.52168316,-0.1264388,-0.30565992,-0.23374599,0.26858535,-0.99716395,-0.40823296,-0.19663967,-0.7894327,-0.23591742,-0.07203679,-0.8244923,-0.294086,0.021706592,-0.8343072,-0.28783843,-0.48780102,0.2973197,-0.19674043,0.26361313,0.9993012,-0.46113387,0.33645225,-0.085004896,-0.06135466,-0.24791779,0.4539029,-0.037581574,0.66727775,0.89384556,-0.9520055,-0.6869982,-0.28655103,-0.32584512,-0.9998179,0.08975928,-0.28914633,-0.5833132,-0.7825157,-0.2706625,0.30925328,-0.17483002,0.64848113,0.32168335,0.99549526,-0.59099215,-0.48787144,-0.00080334,-0.40101504,-0.33711526,-0.80910474,-0.4195877,-0.036579944,-0.4178201,0.33117792,0.99973184,0.44132283,0.44752133,0.5989219,0.41061464,-0.25529087,-0.87905246,0.5778133,0.3342611,-0.63802147,0.6418478,-0.9999077,0.3427757,0.5999517,-0.49067003,0.11862383,-0.35393578,0.17914855,-0.49489248,-0.20449409,-0.4849974,-0.04360561,0.90348274,-0.36422688,0.09807494,-0.6146312,0.16200492,-0.53637594,0.63506776,-0.8069335,0.66942614,-0.8718596,0.03452768,-0.006585051,-0.03679897,-0.013634804,0.64352596,-0.19218934,0.022044176,-0.4519672,0.6759868,0.57285666,0.17843606,-0.60860103,-0.33844936,0.3485926,-0.9510086,-0.8888174,0.42373177,0.07496252,0.52510685,0.63691485,-0.98581487,-0.5301641,0.41581336,-0.3830944,-0.31874776,-0.4205101,0.20544139,-0.74518204,-0.24896234,-0.15204327,0.06666209,-0.040040612,-0.2603891,-0.5371732,-0.7057114,0.43276465,0.78969663,0.4371413,0.55608505,-0.5707755,-0.4453238,-0.44926268,0.65522486,-0.27150813,-0.4180455,0.57797325,0.16377926,0.13867056,-0.999578,-0.2670313,-0.28579703,0.13325672,-0.39524025,0.043935142,-0.22529884,0.20197608,-0.25466245,-0.19215493,-0.38289958,0.018070973,-0.42040652,-0.5326932,0.14349234,0.9811982,0.23175263,0.012745982,0.78022224,-0.23637123,0.1646186,-0.30431664,0.05721168,0.29391378,-0.680375,-0.11099737,0.17755862,-0.42274663,-0.2516136,0.16109183,-0.1113732,0.5991424,0.3398496,0.55558234,-0.7979748,0.70431066,0.4180569,0.39661142,-0.35362896,0.41233325,-0.28211653,0.35464317,-0.97020245,0.025924655,0.41237485,0.36063933,-0.5558475,0.37966627,0.32070276,0.3559775,0.12383125,-0.6251894,0.8236146,0.17961478,-0.19309318,0.70190006,-0.38459364,-0.19461472,0.44816977,-0.3916186,0.033818945,0.07840981,0.39535975,0.30252987,-0.48731482,0.3636547,0.842009,-0.06168124,0.4982157,-0.030927606,0.25976673,0.6197307,0.997898,-0.24048342,0.6135478,0.1375916,-0.17634605,-0.04852544,-0.1889886,-0.96898896,0.070452325,0.24961662,0.97398186,-0.13469641,-0.014783212,-0.09865817,0.09799048,0.999976,-0.96455485,0.10279661,0.5624838,0.3153079,0.5015794,-0.7322057,0.15968385,-0.36775976,-0.42544046,-0.71208286,0.25876486,0.63436276,0.3208042,0.3718661,-0.6747822,0.2322096,-0.19703977,-0.64529294,-0.031112688,0.18570666,0.24071653,0.8847535,0.16548012,0.005305653,-0.14252953,0.53097904,-0.9194499,-0.2886335,-0.34700528,0.56757236,-0.9514035,0.1671883,-0.113185294,-0.07895433,0.10819365,-0.352439,-0.1899983,0.60113275,0.19364958,0.11735967,0.15992941,-0.74305993,0.1878048,0.12512188,-0.056921836,-0.7549735,0.20272669,0.26002362,0.6785425,-0.017049374,-0.53059626,-0.73317724,-0.5856606,-0.96767056,0.22982985,0.06962034,-0.4449109,0.14338069,0.09925259,-0.21398158,0.99956715,0.10566562,-0.11424239,0.042352527,0.2921004,0.366189,0.083529,-0.7881566,0.015620861,0.25562698,-0.2533951,0.30678964,0.14425814,-0.6208993,0.31723124,0.20064946,0.5172268,-0.18492277,0.99357027,0.7263046,0.12461541,-0.28589305,-0.3730048,-0.30375633,-0.20692153,-0.6630209,-0.8532422,0.30088708,-0.47796953,0.022300968,-0.4677416,-0.47290346,0.75390786,0.29993954,-0.021327281,-0.16096646,0.43741047,-0.002285666,-0.5230181,0.19889182,0.16369137,-0.13517779,-0.020103639,0.8215668,-0.018604532,-0.26039475,-0.07733051,0.2772,-0.18935663,-0.38680083,0.9599863,0.7005132,-0.56140596,0.770833,0.79126185,0.052016348,0.36634856,0.38769358,0.28672868,0.96629596,0.28739834,-0.9855874,-0.34221056,0.99870795,-0.43516478,-0.32825974,-0.98511046,-0.44161102,-0.11491171,0.5664884,0.07513577,-0.123336226,-0.3063161,-0.47549722,-0.29791278,0.48920885,0.3723802,-0.3868958,0.30205005,-0.07296678,0.10120257,-0.9999812,0.99537605,-0.7223012,0.59379745,0.07830602,0.8818113,-0.14844187,-0.6996586,-0.8424822,-0.29516107,-0.21526597,0.40249062,-0.854005,-0.33858684,-0.14545903,0.1866673,0.17574663,-0.18067314,0.4139459,0.19261362,-0.9998985,-0.4551433,-0.02020132,0.2200028,-0.5552526,0.29806423,-0.6225176,0.7819228,-0.6274064,-0.28372276,-0.37367266,0.259961,-0.07166691,0.9649943,-0.20698068,0.45854542,0.0533979,0.28827038,-0.44739172,-0.48720694,-0.6183651,-0.41023216,-0.26603082,0.34321153,0.701288,0.24415262,-0.5126303,-0.25310317,-0.4791297,-0.7807547,0.08546046,0.61022455,-0.73908144,0.15441208,0.2630248,0.9844981,-0.4843951,-0.4640191,-0.70116216,-0.12943023,-0.4915009,0.99979633,0.5030607,0.053869884,0.002221747,0.4415856,0.13357975,-0.64099014,-0.9574129,-0.15174764,-0.16485056,0.03317236,0.3768001,-0.41461787],
    [202,1,"CCCC1COC(Cn2cncn2)(c2ccc(Cl)cc2Cl)O1",0.26983082,-0.27756953,0.30730265,-0.25059545,0.06687201,-0.16455258,-0.663332,-0.34463018,-0.06512244,-0.42489135,0.00136515,0.30739158,0.24021131,-0.2532766,0.06087664,-0.028529912,0.41637823,-0.6731608,0.038609676,0.55954325,-0.03482698,0.18916902,-0.59395754,0.1887188,0.19326857,-0.69368935,0.28788543,-0.37286475,0.28950158,-0.5160846,0.004786278,-0.53162134,0.3746019,0.635071,0.4798622,-0.1907646,0.0727641,-0.4796431,0.9969103,-0.8045536,-0.55071354,0.87872046,0.14627643,0.658219,-0.46044055,-0.5840586,-0.46614948,0.27301133,0.8799625,0.33783796,0.56596947,0.50967675,-0.11035875,0.22665787,-0.5278898,0.3098779,-0.1965744,-0.051317267,0.3128535,0.3602846,-0.44091117,0.029274262,-0.051365178,0.21723288,-0.1926104,0.14628786,-0.10580626,0.29658255,0.46968594,-0.5774054,-0.84900516,-0.8926849,0.2823013,0.050772626,0.6338563,-0.516314,0.040848486,0.55657226,-0.23136081,-0.9973001,0.6371821,0.04317754,-0.9636079,0.3962941,-0.07270123,-0.7324879,0.27865368,-0.5634651,-0.25142968,0.3950462,0.34698066,-0.024014197,0.42135677,-0.38638508,0.9960913,-0.4080465,0.5262609,-0.053236563,0.039382137,-0.007594669,0.008205525,-0.50655466,-0.2608334,0.8924593,-0.9683541,-0.95553464,0.03466398,-0.14156513,0.9758349,0.14509541,0.6846701,0.26803803,0.3218647,0.13051209,0.3004929,0.19080606,-0.6772401,0.11605639,0.991492,-0.39497355,-0.3032933,-0.58795404,-0.084198885,-0.12074718,-0.16072392,-0.5006459,-0.18917567,-0.113187805,0.093764246,0.99911416,0.34994373,0.2559683,0.26779038,0.55454385,0.369474,-0.9907655,-0.48589122,-0.17265405,0.0834203,-0.5945244,-0.9999967,-0.5524557,0.8500305,0.13198088,-0.047243338,0.39595956,0.41773754,0.03545787,-0.6783178,-0.09857656,0.16925263,-0.93234944,-0.018024055,0.6140517,-0.29018995,0.3770075,0.3537693,0.6076841,-0.13221301,-0.91106045,-0.86712015,-0.49200746,-0.5934691,-0.83563155,0.44278818,0.7162247,-0.53452915,-0.11060808,-0.3399916,0.22298078,0.1286472,0.31047478,-0.56762385,-0.014485018,0.3522803,-0.33001155,-0.49362865,0.3204761,-0.9118818,-0.35058272,0.3130731,-0.6082166,-0.3287352,0.38487354,0.36412796,-0.0783481,0.47057268,0.59262484,-0.6835307,0.11085396,-0.44675523,-0.2636584,-0.3037647,-0.10450548,-0.42236146,0.7242103,0.56953853,-0.83792603,-0.13847913,0.8356198,-0.42281598,-0.32094058,0.22652195,-0.11362056,0.5303094,-0.08953984,0.26390192,-0.38442922,-0.65908015,-0.99972296,0.046466786,0.49220997,0.21256645,0.22319712,-0.062941246,-0.46156535,-0.44169056,0.40406492,0.18760695,-0.11325068,-0.27829584,-0.21068744,0.7893556,0.30943614,-0.980908,-0.024069669,-0.12796667,0.6072929,0.4556505,0.541874,-0.012537153,-0.6450443,0.6284244,0.44375452,0.76002944,-0.22254133,0.29211038,-0.82351625,0.16789941,-0.28109422,0.95179313,0.007724756,0.037700903,0.14217193,0.40851754,-0.77364784,-0.070601456,-0.101059236,-0.090140544,0.91055614,-0.07090844,-0.7554931,-0.023557559,0.078940734,-0.3839113,-0.5161357,0.8280744,-0.10158134,-0.37946135,-0.023790805,0.22400028,-0.5330655,-0.048428956,-0.2814672,0.495846,-0.26272422,0.45579475,-0.08927128,0.79009086,0.33707628,-0.13180181,0.99635273,-0.55599946,-0.22728951,-0.32486278,-0.19543591,-0.08820857,-0.5243164,0.5444663,0.074897,0.75785315,0.99770373,0.7837883,0.0359489,0.44054598,0.18503375,0.3969779,0.8491085,0.93774384,-0.32220346,0.28772423,0.96889824,-0.5150808,0.6869473,-0.20842625,-0.39400405,0.99999934,-0.9736115,-0.4707418,0.5305005,-0.54010206,0.42436963,0.1916587,0.39479637,0.5626126,0.49383786,-0.8659498,0.13827743,0.5407892,0.6674119,0.017937725,0.58366895,-0.47941557,0.5602699,0.5972928,-0.42676586,0.20743714,-0.57562983,-0.9999719,-0.46613753,-0.3027363,-0.76240414,-0.22727571,-0.6824752,0.23215123,-0.6731395,-0.71397614,0.22633259,0.22397862,0.005219212,0.12735963,-0.22058056,0.08342436,-0.4871055,0.09300785,0.40306535,-0.039614886,0.8852124,-0.019297676,0.56931096,-0.69371295,-0.6928057,0.64437807,0.15960805,0.06880967,-0.6105233,-0.8818045,0.33473372,-0.4675889,-0.57888865,-0.9504662,-0.35067663,0.6911161,-0.07885892,-0.34217438,0.34210214,0.8281597,0.9995789,-0.30634683,0.015441076,-0.4023761,0.15486446,-0.022396976,0.6860636,-0.563329,-0.07419488,0.36000904,-0.3027678,0.053710178,-0.37431365,-0.22881627,0.21110393,-0.10823585,-0.6422874,0.079033226,-0.99649173,-0.054645754,-0.000976726,0.4727262,0.71305794,0.29586,0.5842718,0.18216607,0.30369884,-0.07400467,0.41190147,0.00368354,0.27352405,0.015942883,-0.33996016,0.5427181,-0.39761096,-0.29992977,0.28656888,0.13438004,0.17072505,0.3197259,-0.6532977,0.6609814,-0.26927778,0.43752876,0.5420275,-0.48963025,0.7241535,0.074554875,0.039949376,-0.83560413,0.13222459,0.26494005,0.014246731,-0.49159157,0.65437365,0.28618744,0.7275161,0.38923484,0.017004466,0.99999976,-0.61382145,-0.93611234,-0.57677805,0.998753,-0.6934149,0.25422385,-0.9999445,0.654072,-0.65615785,0.034820404,-0.5896068,0.30383414,0.083360754,0.15162925,0.3940337,0.014361669,0.22999315,0.16597177,-0.1289981,-0.0684225,-0.39989614,-0.9999726,0.9999999,-0.6373359,-0.47767165,0.48215967,0.1497176,0.4837202,-0.12556437,-0.1619014,-0.40286413,-0.32254353,0.399994,-0.34224132,-0.5135897,-0.35358712,-0.2263949,0.042542346,-0.1769365,-0.5997916,0.21079142,-0.999744,0.6461745,-0.8585972,-0.48445967,0.113972835,0.58248687,-0.8116378,0.07617088,-0.20441219,0.21795757,-0.34482002,-0.71873516,0.5788015,0.9335942,0.36954618,0.21205802,-0.06327968,0.4210848,0.14794761,0.30267087,-0.17051734,-0.61064416,-0.37965414,-0.033707146,-0.8225128,0.6279556,-0.3396366,0.20762764,0.34346765,-0.113238834,0.15462784,-0.21247461,-0.6809867,0.16210908,0.43339145,0.9910904,-0.23663671,-0.02590984,0.2230675,0.09371296,0.34207612,0.999833,0.6363735,0.4241371,-0.0876405,-0.028812902,0.4668392,-0.1604555,-0.9931202,-0.47890028,-0.0595335,0.1885963,-0.5508993,-0.031378888],
    [203,1,"O=C1OC(c2ccc(O)cc2)(c2ccc(O)cc2)c2ccccc21",0.67621934,0.22226356,-0.13958026,-0.14539988,0.78983533,-0.6508371,-0.6811363,-0.29556313,0.5716392,0.31424743,-0.40508243,0.4140188,0.11261306,-0.6846372,-0.17876577,0.64229673,0.06922423,0.05222354,-0.2922023,0.0792945,-0.007168982,-0.4993981,0.3420171,-0.025361307,0.036749564,0.070624776,0.29568788,0.52681565,0.7795713,-0.2244656,-0.033136245,-0.3637486,-0.2632151,0.598751,0.55330926,-0.6441474,0.04764407,0.121943794,0.9991296,-0.80991703,-0.70594835,0.48416305,-0.31765583,0.60225767,0.7421657,-0.4311745,-0.16784737,-0.3719753,0.9358731,0.73629653,0.4351029,0.21937141,-0.01709927,0.09318483,-0.7343975,0.4335632,-0.61551774,-0.52808243,0.092360795,0.46330017,-0.2997394,0.001802608,0.5551686,-0.6110827,-0.25815842,0.75104856,0.31062865,0.62271357,-0.025107324,-0.19910589,-0.09555377,-0.7834102,0.49153286,0.076754354,0.7514411,-0.29164496,0.35541335,-0.18938822,-0.24390562,-0.98592037,-0.8704648,-0.028953338,-0.8684745,-0.09275373,0.27630344,-0.74138415,0.10069878,-0.3801398,-0.19011578,-0.20852764,-0.17503145,-0.62100405,-0.33596787,-0.040790297,0.98703706,0.06764124,0.4250346,-0.05384794,-0.037163097,0.30080572,0.009858898,-0.06752818,0.3522832,0.844313,-0.99577487,-0.42229488,0.070453145,0.32503802,-0.9980523,-0.06423958,-0.31589767,-0.1761179,0.16102296,-0.031800956,0.2449023,0.5974763,-0.38382304,0.35891643,0.98701376,-0.2251539,-0.1908518,-0.69428515,-0.019923285,-0.1011463,-0.62667567,-0.46518093,-0.6837363,0.31936726,-0.78546584,0.9995617,-0.19636697,-0.20430303,-0.24685812,0.07019509,-0.13821515,-0.5693554,0.7550841,0.63081175,-0.5026375,-0.60449666,-0.9999987,0.5422639,0.8636918,0.14705122,0.7675791,-0.17652042,0.012105274,-0.52716464,-0.95043254,-0.4051153,0.07476884,-0.636513,0.49412522,-0.010241669,-0.14005274,-0.56768304,0.32457432,-0.3449525,-0.70785797,0.053426057,-0.7942752,0.26002324,-0.48799774,-0.37442064,0.065730095,0.65088254,-0.10294467,0.5227066,-0.4508214,-0.5598566,-0.7161721,-0.33484444,0.5585009,0.2217364,-0.0945391,-0.9647638,-0.71531343,0.44407034,-0.5859154,0.2902755,0.5043368,-0.80421895,0.18899024,0.4909813,0.39666536,-0.41676804,-0.019244863,0.5192573,-0.56849587,-0.4114312,0.46972734,-0.14274965,-0.1619803,-0.36884063,5.92e-05,-0.5700387,-0.107450575,-0.10402851,0.6465114,-0.1569772,-0.38593194,-0.040049758,-0.40892395,0.66791755,0.47466537,-0.30178836,0.5745089,0.08132661,0.290173,-0.99985194,-0.44538033,0.5010732,0.6493592,-0.20830709,0.3517482,0.023230063,-0.2528872,-0.2713736,-0.2646027,-0.044217143,-0.3533042,0.27115965,-0.30507964,0.41828,0.9996965,-0.35078216,-0.03239976,0.33557826,0.042604133,0.28741437,-0.4007277,-0.8028065,0.83771545,0.012683917,0.09135039,-0.113517374,-0.49875188,-0.39083153,-0.01836128,0.66730195,0.7666173,0.13872802,-0.1288221,-0.33359456,0.7853378,0.29498553,0.27075374,-0.2198438,0.399289,-0.04341136,0.001296524,0.16309395,0.12000743,-0.12579454,0.4685553,-0.51134735,0.21863052,0.7088794,0.6679474,0.46769515,-0.5057811,0.32141915,0.5575505,-0.7912777,0.35563728,-0.13510258,0.5951244,0.30156153,-0.6557437,0.09293905,-0.6217567,0.96468973,0.046079163,-0.50012386,0.30744892,0.87118113,-0.16001505,0.091613375,0.21482633,-0.11879446,0.51105696,0.99691963,-0.46550858,-0.2627453,-0.012480097,-0.40108114,0.040014815,-0.02898567,-0.8958722,-0.34504354,0.5042163,0.8602081,0.10933071,0.4221054,-0.33049536,0.17950767,0.9999999,-0.98230493,0.14639674,-0.40123752,-0.5089096,-0.47164297,-0.12874858,0.31879872,-0.5840793,-0.8638202,-0.94656914,-0.24216129,0.61623174,0.22948022,0.22286712,0.040853914,0.31263664,-0.3358529,0.22505002,-0.59233665,-0.110735044,-0.26167667,0.90990967,0.13776107,-0.52099764,-0.21077076,0.24866655,-0.7270353,-0.16176389,-0.13613626,-0.726809,-0.82214195,0.16576312,0.2324847,0.122563295,-0.5587999,-0.1651987,0.22543,-0.43970233,0.41427132,-0.2688967,0.55025375,-0.025279993,0.16551906,-0.1517196,0.4231543,0.053104796,0.45486566,-0.30523235,-0.7158548,-0.7912237,-0.23973477,-0.47212428,-0.8127184,-0.91406184,0.36910763,0.031077659,-0.29814038,0.08711792,0.40144432,-0.24995638,0.99895364,0.2856,0.61488384,0.019969653,0.002167247,0.007415437,0.08224628,-0.95919967,-0.12546915,-0.3723919,0.25370622,0.037961308,0.70692474,0.31487572,0.33008486,0.85454315,0.18023443,0.3240379,-0.9999999,0.4505451,0.34961036,0.39845082,0.6835756,-0.72088265,-0.40279734,-0.48332393,-0.56930715,-0.30400035,0.08889092,0.22141175,0.58545446,0.11186771,0.14846349,-0.11410023,0.2317194,-0.5078187,0.1955908,-0.3336278,0.10214495,-0.25588965,-0.28976858,0.7868483,-0.21598296,0.37669986,0.32731333,0.18613215,0.08514192,-0.22159173,-0.012134106,-0.5680342,-0.413985,0.16720983,0.07620343,-0.5818126,0.45375428,0.08728154,0.13515079,0.019235823,-0.22859052,0.93790203,0.12909906,-0.9703994,-0.036518797,0.9991524,-0.67633605,-0.40587476,-0.955942,0.27775496,-0.17918685,0.79039615,0.004211654,-0.6596042,0.20333663,-0.3719229,-0.44767287,-0.6388049,-0.27809742,-0.6568209,0.098311834,-0.3908326,0.14477575,-0.9999868,1,-0.47620425,0.12023755,-0.09987042,0.3318886,-0.07440465,-0.38187268,-0.75946826,-0.08568789,-0.5303507,-0.049181312,-0.91822606,-0.42852744,-0.1880067,-0.46838066,0.53326875,0.27118552,0.2342728,0.65421057,-0.99986714,-0.16134293,-0.48823306,-0.22244269,0.055204768,0.067037374,-0.84499013,-0.01912181,-0.43996912,0.0827895,-0.34418803,-0.6260923,-0.10752876,0.96073186,-0.38948852,0.04362582,0.021698065,0.59761405,0.40821424,-0.78381956,-0.6111578,-0.31819412,-0.423594,-0.20805058,-0.98369336,0.17768557,-0.45660824,-0.24398696,0.04646091,-0.60187507,-0.22616778,0.42420936,-0.42282942,-0.1653263,-0.15394606,0.99506545,0.27527,-0.27784342,-0.035855748,0.064947374,0.1915343,0.9990595,0.7372084,-0.26188907,-0.5239524,0.24053013,0.25398225,0.32928598,-0.98955536,-0.41947135,0.6538151,-0.46244043,0.19347844,-0.22237426],
    [204,1,"N#CSCSC#N",0.3770388,0.43119377,-0.24479961,-0.39289942,0.48887163,-0.48018026,0.25601405,-0.7131326,-0.18810554,0.13329078,0.2125686,-0.36009696,0.13847518,-0.3681511,0.4469196,0.5181645,0.102256075,0.44053316,0.72889346,0.4732262,0.7041103,-0.4089644,0.19604222,0.0904689,-0.07272023,0.69958484,-0.20396839,-0.23205537,-0.2681297,0.1570098,0.54118806,0.4356073,0.48676646,-0.19464487,0.006429986,-0.30614698,0.35828784,0.38028973,-0.9454783,-0.9299342,-0.9269461,0.09405267,0.088210516,-0.30752307,-0.4367346,-0.98999405,0.37154025,-0.65055513,0.9936428,-0.061914366,0.12988959,0.4779769,-0.57001656,-0.12500884,-0.80392367,-0.28911427,0.56158805,0.9758073,0.07237072,0.13124433,-0.20474975,-0.2794672,-0.019279966,-0.23876119,-0.6621184,0.1739378,0.3510738,-0.38430867,0.10760563,-0.1275529,0.66160005,-0.9981903,-0.84364814,0.6993239,-0.15076485,0.2829227,0.6766476,-0.7491255,-0.23317212,-0.99986684,0.005098268,-0.7758668,0.29661635,-0.16676742,-0.32961002,0.93400276,0.13629058,0.2652352,-0.48474544,-0.24416576,0.047243193,-0.17653243,-0.016749289,-0.31678343,0.98026544,0.5635761,-0.8860816,0.66453266,-0.029501768,0.6009858,0.16231816,-0.76708615,0.5365678,-0.79822576,0.99449587,-0.8419094,-0.08430866,0.5395046,0.9918339,0.41475248,-0.8143324,-0.26357934,0.074299775,0.95410645,0.36620086,-0.6326831,-0.18071853,0.012762802,0.9969686,0.14210995,-0.38322532,0.32857606,0.23727547,0.5355138,-0.14195861,-0.16080044,-0.7352107,0.03517398,0.22213542,0.954473,0.5719057,-0.44288042,0.46563748,0.2922051,0.00245405,-0.8448519,-0.78266805,-0.6606613,0.664375,0.09801857,0.99803424,-0.055667263,0.91641027,-0.28710994,0.21408191,0.3975571,-0.29479024,-0.13987967,0.99471986,0.49295756,0.38528642,-0.6329769,-0.06854733,0.13868096,0.13717546,0.030772112,0.44988576,0.9993897,0.40539375,-0.93633753,-0.97968984,0.13354361,0.40546355,0.17368728,0.27957335,0.0821934,0.047177892,-0.5120722,0.02544584,0.82156247,-0.316043,0.3048567,0.19895409,-0.031331774,0.6464669,-0.63662916,-0.7726485,-0.27051806,-0.63965374,0.0621432,0.38764513,-0.91052777,0.38892788,-0.23172402,-0.8695652,0.4037743,0.5144592,0.082589,-0.7844563,0.48290652,0.21985465,0.37298825,0.42888036,-0.22135934,-0.5491143,-0.35591698,0.21861106,0.19456634,-0.61918396,-0.25532255,-0.6276687,-0.75045204,-0.11448709,0.3475311,-0.61958086,-0.46035004,-0.37069604,-0.4803784,0.3692013,0.6688358,0.34503284,-0.031297136,0.24997297,-0.21471345,0.23606823,0.4110425,-0.65295935,-0.27703372,-0.5297289,0.20471174,-0.668126,-0.50253433,0.636504,0.36553815,-0.8515729,0.34702557,-0.50464284,0.17228761,-0.34671697,-0.27500463,-0.09563179,-0.4700964,0.11855794,0.16199401,-0.27556992,-0.41363212,-0.58852905,0.3824896,-0.3100341,0.19146852,0.80335253,-0.7688454,-0.04170706,0.66179866,-0.19030334,-0.1617311,0.6754754,0.4169948,-0.23483574,-0.32885748,0.21946536,-0.9991534,-0.00925314,0.7527996,-0.7179326,-0.2802494,-0.32013282,0.30237967,-0.13567777,0.13817948,-0.33342445,-0.18121386,0.021500517,0.5417029,-0.13453658,0.45997962,0.2772329,0.09261275,0.60343736,0.154531,0.4315697,0.94007367,-0.54070044,0.46422663,0.3199693,0.943503,0.030458538,-0.6577752,0.0677692,0.9089629,0.089403175,0.9966722,0.03296411,0.7595155,-0.5008391,0.5931623,-0.37356344,-0.2228552,0.82086873,0.22032052,0.0382042,0.9989388,-0.32713968,0.73614633,0.6774508,0.570541,-0.9929003,0.30168682,0.5990913,0.12302927,0.44805393,-0.05330702,0.5080292,0.25929025,0.066438615,0.48845288,0.9996497,0.52835244,-0.3279816,0.36794296,0.6456304,0.30882892,-0.04793389,0.3275629,0.3189472,0.69839585,0.25678673,0.6243724,-0.9998862,-0.5953939,0.10893462,-0.3327404,0.026411112,-0.6327194,0.69751,-0.18409193,-0.15680645,-0.07708236,0.52033025,0.17753749,-0.25467193,-0.15770787,0.39913744,0.66647565,0.3912199,-0.7086539,-0.4461409,-0.54815793,-0.07918013,-0.8024802,0.40658134,-0.42434523,-0.39163533,0.7952185,0.16690463,-0.44180208,-0.51018673,0.7434843,0.08263472,0.9800301,-0.98705536,-0.45386443,-0.26985404,0.815153,0.46287215,0.7310214,-0.4368239,0.85079163,-0.5584285,0.64481175,-0.5712607,-0.055218995,0.6421026,-0.23660724,0.30638018,-0.44635215,0.25984645,-0.4164871,-0.39073923,0.49025217,-0.073737085,0.08696078,-0.2466705,0.875464,0.312555,1,-0.12551154,-0.013502265,0.45624855,0.107169285,-0.90098083,0.71532595,0.787066,0.089484766,0.7390503,-0.42359233,-0.19549266,0.44958177,-0.7057629,0.28044388,0.3559022,-0.66393656,-0.4949068,0.018527968,-0.23594736,-0.48925307,0.79213136,0.86114097,0.016252672,0.04049531,-0.5680918,0.046244815,0.67825633,-0.31612596,-0.356976,0.25504115,-0.7151118,0.8895516,0.8254481,-0.004000062,0.6586331,0.23878767,-0.2714093,0.13485573,-0.049168468,-0.040235337,0.9999996,-0.3852539,-0.1660898,0.115213044,0.90660423,-0.4900121,0.163706,-0.99991196,0.3354598,0.12627946,-0.18714859,0.36492115,-0.66636294,-0.14813629,0.06083427,0.9008861,-0.09342951,0.63293594,-0.3583193,0.559743,0.16344717,-0.62388366,-0.9995649,-0.99999964,-0.9962324,-0.6781963,-0.15138102,0.11271055,0.061217647,0.42514136,-0.001957213,0.19827828,0.88422114,0.3869969,0.16076092,0.67820174,-0.004926673,-0.4300894,0.14847524,0.061227378,-0.11253706,-0.99705535,-0.998775,0.59298384,0.6468094,0.3016571,-0.40097338,0.6493751,-0.47254094,-0.504435,0.7004364,-0.4422879,0.17847885,-0.38777888,0.39695588,-0.78118443,-0.33514515,0.66348064,0.5582258,0.16153163,0.4859,0.21218064,0.1665651,0.27526084,-0.48253685,0.95405024,-0.9831632,0.15262558,0.1712639,-0.011046254,-0.3364367,0.7142703,0.63129324,-0.13469718,0.4289168,0.51871926,0.29475912,-0.99480176,0.8143088,0.32499197,-0.39483118,-0.08883254,0.47647607,0.99980766,-0.66845614,0.5511589,0.70638627,0.515885,0.5939898,0.43791595,0.94282776,-0.09838691,0.369241,-0.6469365,-0.12337365,0.38523582],
    [205,1,"Cc1[nH]cnc1CC1CCc2c(C)c3ccccc3n2C1=O",-0.08621379,0.14113687,0.34848636,-0.6149948,0.39130816,-0.4337987,-0.14187206,0.04998122,-0.75162745,0.07212313,0.13154642,-0.114919655,-0.19714181,-0.73404664,-0.057009645,0.29176274,0.22484954,-0.08924804,-0.20088558,0.1528598,0.50620306,-0.47938347,-0.5967513,0.5740664,-0.88795805,0.015665276,-0.003722144,-0.18915604,-0.07647718,0.40426034,-0.33629048,0.18483019,0.6458567,-0.89062774,-0.4394948,-0.42169034,0.3012261,-0.3558851,0.99794024,-0.61576504,-0.77376384,-0.04717821,-0.57447004,-0.18948975,-0.38223457,-0.70357615,-0.18598792,0.13982943,0.09475799,-0.24481106,-0.31143892,0.07640915,0.4563829,0.17517914,-0.6540299,-0.20770621,-0.42198962,0.019822568,-0.17827342,0.34012312,0.79368603,0.002254849,0.103071116,0.4623653,-0.101795174,-0.6756558,-0.20275627,-0.56738144,-0.1447628,0.17675692,-0.8745932,-0.9193718,-0.11811071,-0.67885345,-0.007293657,0.40464938,-0.59053683,-0.1470536,0.380466,-0.9998713,-0.76040626,0.14964655,-0.98250985,-0.035993718,0.063480444,-0.84640193,0.41454577,-0.4476,-0.47293603,-0.18605119,0.23858446,-0.113528125,-0.67474216,-0.14993131,0.9846665,-0.33232057,0.47259912,-0.2906497,-0.17678875,-0.09440386,0.14824682,0.19074862,0.12853435,0.92667204,-0.9804129,-0.4709017,-0.59751666,0.42023253,-0.9757274,-0.0366991,-0.6782945,0.94522804,0.6030507,0.32098317,0.05353931,0.63254166,0.31436652,-0.6094018,0.98889375,0.06740738,0.085506946,0.404968,0.3031691,-0.022982342,-0.5519447,0.21064122,0.4863727,0.03541701,0.44279197,0.99972063,-0.18869036,0.116500445,0.23531975,-0.2932167,0.8574306,-0.9784508,0.6531196,0.75349754,-0.5922494,-0.40150645,-0.9999987,0.16754358,0.9003869,-0.45945626,-0.7035105,0.5518193,-0.17858201,0.09509034,-0.8148216,0.29688916,-0.07625274,-0.682081,0.6862794,0.5730428,0.18936293,0.005155186,-0.17287166,0.4790246,-0.13321021,0.38293436,-0.87096256,-0.44195896,0.3013656,-0.063459985,0.15414977,-0.44621903,0.2409572,-0.80845696,-0.098978326,0.7229706,-0.4345589,-0.69321954,-0.29316688,0.30521518,-0.23320904,-0.63803416,0.16031614,0.684349,0.07950006,-0.77144927,-0.08940537,-0.7959192,0.5328393,-0.026963692,0.057415985,0.5206013,-0.30284572,0.37790993,-0.36669296,-0.1424915,0.27339822,0.29293588,0.5668592,0.3692833,-0.7159646,0.38489494,0.559115,-0.4984542,0.42147166,0.12632997,0.82177573,0.3408089,-0.30802456,-0.287217,0.7513187,-0.29982325,0.7781564,-0.43753195,-0.02125391,-0.999866,0.2891831,-0.16468534,-0.5477585,-0.3200316,0.09180434,-0.103810616,0.07570418,0.5571937,-0.120612636,-0.4627577,-0.50280213,0.23545264,-0.27824178,-0.22742806,-0.95127445,0.11981337,0.36409593,0.09104932,0.050733607,-0.4606683,0.030922534,-0.54337215,-0.10750425,0.438832,-0.23664631,0.22969507,0.4019105,0.3547181,-0.43245462,-0.41555887,-0.9558008,-0.49942765,0.19678284,0.24421935,-0.24675354,0.5122238,-0.5554654,-0.30662715,0.8464075,0.09200191,0.5112535,0.16223514,0.20499161,-0.23515819,0.17053556,-0.3192505,-0.13644193,-0.5399783,-0.06278645,0.4207269,0.47927895,0.2775255,-0.37610763,0.005264911,0.66033876,0.83068746,-0.31154004,-0.1912765,0.4028939,0.017893117,-0.75432163,0.99132276,-0.054367434,0.55584145,0.26465854,0.10647216,-0.2746569,-0.50383633,0.13988784,0.08560742,0.20183992,0.9981014,-0.69534975,0.44875625,0.35652956,0.15925369,0.16872181,0.37876377,0.731781,0.2866556,-0.00304657,0.9571208,-0.5968177,0.015198207,-0.47761208,0.12174573,1,-0.98376715,-0.23021717,0.502528,-0.15995216,-0.44991866,-0.45226634,-0.6748492,0.7412114,-0.17937459,-0.8371192,-0.18166456,0.27162746,0.09849062,-0.46492076,-0.66511256,-0.23251773,-0.10387876,0.39554775,-0.4626174,0.27753147,-0.1943466,-0.8817687,-0.54780006,0.2107159,0.3612137,0.7174889,-0.19326629,-0.25650805,0.19421576,-0.06705589,-0.7468156,-0.07729658,0.23025958,0.4375431,0.4702293,-0.12726296,-0.27118328,0.70204663,0.47537857,0.07079454,0.6472546,-0.52220464,-0.1996289,0.298641,-0.05926643,0.72812086,-0.30978924,0.058033194,-0.23404366,-0.059196696,-0.078105874,0.24377665,-0.6747397,-0.9631312,-0.5049413,0.09968177,-0.039021496,-0.07965509,0.65332276,-0.62188715,0.99949384,0.4300044,-0.6127552,0.089473836,0.6932082,0.30517313,0.3879479,-0.86237866,-0.044912294,0.21503046,0.043128397,0.28272977,-0.3768779,-0.07228046,0.24431597,-0.08112966,-0.5404563,-0.30458653,-0.99999976,-0.17777455,-0.16001415,-0.26163927,0.19169505,-0.32135388,0.11630224,-0.37185192,0.40854952,-0.30804572,0.16271196,0.33033007,-0.34732053,0.25101498,-0.4155712,0.061970264,-0.5049918,-0.038861744,0.3748057,0.08665013,0.37352842,0.736674,-0.62252146,0.27083382,-0.16564274,0.025325198,-0.46199304,0.074347764,-0.673731,0.014935688,-0.15684055,-0.40592694,-0.8463997,0.003506804,0.45602044,0.51949036,0.040862717,-0.52002394,-0.80626243,-0.06896305,0.10660436,0.99966884,0.2711727,-0.97555,-0.20892394,0.99963725,0.30023342,-0.44975334,-0.9989681,-0.086883865,-0.3298083,-0.38697103,-0.7118692,-0.42194876,0.23151456,-0.8278761,-0.06634145,-0.46700168,-0.09393294,-0.4525583,0.29482362,0.2946914,-0.39086232,-0.9999548,1,-0.31068718,-0.17328179,0.57530075,0.09254722,-0.005363789,0.08428642,-0.12930857,-0.28677657,0.3479387,-0.37237272,0.087917574,-0.3187588,-0.029289706,-0.043032646,-0.74666554,0.5493621,0.3304225,0.19897434,-0.99982035,-0.6704774,-0.7475338,-0.58738244,0.20187646,0.37605318,-0.90545714,-0.67222875,0.2672564,0.010002893,0.013970936,0.7884642,0.4023264,0.98427254,0.35659078,0.72027045,-0.09244724,0.33093807,-0.14049073,-0.25143188,0.42517722,0.5630692,-0.2524422,-0.23219305,-0.5914546,0.46569467,-0.2897563,-0.021691725,0.046494868,0.115998045,-0.3745399,-0.25910512,-0.6695806,-0.058808714,-0.42185125,0.9904667,0.9389657,0.3049912,-0.22145806,-0.35421294,0.36373332,0.9999737,0.12475015,-0.4322883,0.4440356,0.2390164,0.46770215,0.8191207,-0.9941337,0.40865365,0.5290997,0.096925184,0.45828536,0.07122569],
    [206,1,"NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F",-0.75966555,0.47276935,-0.84336627,-0.26527247,0.77252895,-0.81465375,-0.59431815,-0.37296358,0.047485754,-0.7567665,0.5325312,0.4328861,-0.25812218,0.9181626,0.16912754,-0.9965511,-0.5152468,0.3033059,-0.24473926,-0.8430759,-0.4025155,0.57827735,0.63112956,-0.7751253,0.6797421,0.7056129,0.61364466,0.5845641,0.96014994,-0.12402318,-0.43649292,0.6534036,0.20301838,-0.23080742,0.32555538,0.8964497,0.18560687,0.7496957,0.99988496,0.71400106,0.1605779,-0.19413842,-0.004389876,-0.61019605,-0.004611353,0.75375664,0.87732863,0.67625195,0.9801534,-0.66237944,-0.6357935,0.02795429,-0.30367175,-0.060889687,-0.621,-0.3480207,-0.82814735,-0.9939241,-0.8988328,-0.37622893,-0.13013169,0.42479438,0.11469261,-0.036014203,-0.15083638,0.862197,0.14577585,-0.6188944,-0.2197633,0.50477433,-0.7805375,-0.5481978,0.37018642,0.85078084,0.3050899,-0.77103406,0.7832358,-0.67714965,-0.6288672,-0.99813795,0.1058261,0.2768604,-0.8253651,-0.31107184,0.28140897,-0.68628067,0.20718467,-0.25831705,0.38058805,0.68710065,0.47502336,0.45961788,0.21978416,-0.43370026,0.98734057,-0.29182115,0.13346739,-0.08434026,-0.21708867,0.17260048,-0.25054914,-0.4847301,-0.25573224,-0.39895403,-0.9998276,0.5272463,-0.008504438,0.35661757,-0.8347855,-0.042766318,-0.7733112,0.047054753,-0.92513925,-0.74588984,0.67636275,0.35547623,0.33708876,0.82981664,0.9287625,-0.8402725,0.671215,0.20196778,-0.24073692,-0.57142013,0.5839862,0.68723154,-0.8110778,-0.106393985,-0.23728669,0.9994515,-0.3696236,-0.5562329,0.9225907,-0.565706,0.28791445,-0.87483895,0.46861842,0.6012052,-0.8979916,-0.75526714,0.9993336,-0.47968054,0.6876724,-0.07726084,0.4912846,0.26137197,0.81127775,-0.124197006,-0.99868727,-0.1929704,-0.6693003,-0.39455062,-0.30880943,-0.82994115,-0.8546233,-0.47068807,0.31904832,-0.9776964,-0.9713045,0.12979293,0.5917899,-0.6918459,-0.55043924,0.19400482,0.28331327,0.42063206,-0.78601897,0.13909622,-0.3300344,-0.44075686,-0.89049536,-0.8151007,-0.17133251,0.6766948,-0.3719545,-0.8849385,-0.88181776,0.6900214,0.62571055,0.3112983,-0.6779638,-0.9310006,-0.43936217,-0.950875,0.9619639,-0.42661124,0.6891955,0.7093505,-0.6698592,-0.9667719,-0.17390656,0.7355867,0.6829356,0.13396671,0.4225036,0.21260473,0.43405712,-0.5209414,0.048452772,-0.5033724,-0.7882803,0.26769355,-0.47968867,-0.89011127,0.43597206,0.31858957,0.52387434,0.49566996,-0.7999598,-0.9999433,-0.08031664,0.7965732,0.44660965,0.1381997,-0.8546962,0.5127965,0.18554443,-0.1451322,-0.075856,0.52666134,0.22169164,-0.15377206,-0.15810628,-0.044454597,0.95083416,-0.34256226,0.60915214,-0.099738955,-0.087596886,-0.89097786,-0.6814445,-0.47422817,-0.27513206,-0.18963392,-0.8012406,0.42255184,-0.14709005,0.59704566,0.20675196,-0.6659096,0.46603027,0.9108065,0.8927245,0.37770948,-0.98504287,0.42271546,-0.42366904,-0.5504777,-0.6654305,-0.28203642,0.7456103,-0.9996711,-0.49785972,0.43656516,-0.30998027,-0.60472494,-0.5595796,-0.6595617,-0.70876914,0.383023,-0.61645156,0.25534537,0.09644691,-0.3518452,0.5882808,-0.8526585,0.579083,-0.19583842,0.87131655,0.29589516,-0.86889786,0.99825317,0.7527264,0.6936406,-0.07154512,0.91102,0.40755635,-0.87758696,0.41552836,-0.9925096,-0.12139552,0.89236426,-0.29471245,0.17979777,0.38773438,0.44878045,-0.9073554,0.81324726,-0.96645725,-0.96603286,-0.7204239,-0.26940483,-0.8321337,0.57886153,0.5192765,-0.55022144,-0.99650824,-0.99440235,0.019485286,-0.47582883,0.059575364,-0.58777195,-0.6347323,0.8108962,-0.22632883,-0.001787124,-0.9968629,0.32534492,-0.08105748,0.020208443,0.6199489,0.10717031,0.18900862,-0.027254796,-0.2981953,0.9042922,-0.35882288,0.4314339,-0.9434708,0.014117568,0.6626131,0.661493,0.5999466,0.63742924,0.10950901,0.7952043,0.15793397,-0.94275683,-0.94924176,-0.30594698,-0.60548824,0.41142327,-0.01964241,0.1601658,-0.124514,0.93489826,-0.92528164,-0.86722344,-0.20698434,-0.2522566,-0.8924161,0.33821252,0.8407595,-0.90010643,-0.118060105,-0.7282488,0.18583032,0.49114048,0.6632886,-0.958078,0.32267255,-0.15083462,0.89293045,-0.46909592,-0.20054534,-0.32469052,-0.29627618,0.9999568,-0.37604126,-0.54949576,0.053074352,0.7826938,0.11783703,-0.43325898,-0.9270472,-0.20729756,0.74357665,0.8911504,0.21588467,-0.2885766,0.35830542,0.10462896,0.90963036,-0.18411241,0.04279182,1,0.22030334,-0.7055025,0.12435661,0.036108393,-0.8713426,-0.28382432,-0.83808696,-0.3330894,-0.13034326,-0.5109601,-0.7618752,0.79019266,0.6996399,0.7003763,0.11338635,-0.5809117,0.7368469,0.52162796,0.70786977,-0.9993121,-0.70013356,-0.6911758,0.78126615,-0.09524295,0.75627184,-0.3684487,0.32425344,-0.56406236,-0.27232173,-0.2190596,0.018221958,0.094601125,-0.5097886,-0.07974231,0.71106964,0.03192477,0.4014894,0.69549227,0.653299,0.87033623,0.99989754,0.12451055,-0.9921386,0.22779147,0.99888,-0.980898,-0.48545733,-0.9992841,-0.477959,0.06477579,0.29444858,0.45413965,-0.5122467,-0.4972045,-0.03834879,-0.8738512,0.2540791,-0.62296724,-0.54144424,-0.48908067,-0.647908,-0.09277678,-0.9999603,-0.99999964,-0.22804455,0.17829396,-0.04195458,-0.6823955,-0.1814419,-0.617246,-0.45325184,-0.43052277,-0.85817933,0.79993236,-0.69394296,0.18451257,-0.009459973,0.26005638,0.35406682,0.6985323,-0.64270735,0.9536615,-0.9988453,0.6884841,0.8865262,0.42138228,-0.545155,0.19466692,-0.56632864,0.4516197,0.17604001,0.50425506,0.5050231,0.097381964,0.5851223,-0.95647997,-0.49632943,-0.39194033,-0.3902077,-0.57324815,-0.55850244,0.64800066,-0.7277129,0.5258058,-0.8980048,-0.67830384,-0.99965715,0.283661,-0.072164305,-0.04393886,-0.5216146,0.7507993,-0.48258325,0.9219936,-0.7421864,0.28002676,0.63063866,0.9988975,-0.1297217,0.8793703,-0.17062293,0.4358765,0.2502626,0.9900202,0.8228728,-0.7832668,0.003652062,-0.22774324,-0.6629314,0.86118037,-0.9987604,-0.21039191,0.32550105,0.9761047,0.86548233,-0.016999254],
    [207,0,"CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O",-0.2178692,-0.43085635,-0.11219191,-0.03592213,-0.2862827,0.25001934,0.39132133,0.14578542,0.17360125,0.43067178,-0.61385405,-0.004668261,0.2216207,0.223459,0.033012975,0.58662117,-0.61509717,-0.42107278,0.43504724,-0.26875418,0.13130109,-0.32810935,-0.5628251,0.15158485,-0.17051572,-0.025699263,-0.20700864,-0.41796055,0.07297291,-0.5722487,-0.7284875,0.39811382,0.76004606,0.56852174,-0.38818136,-0.45113653,0.2966606,-0.122231424,0.9968006,-0.2510672,-0.71598065,-0.09591162,0.15301497,-0.15868475,0.16219622,-0.7102647,0.4166112,-0.443921,0.9683803,-0.36191854,-0.11720192,0.3095862,-0.11372455,0.7915684,-0.8712154,-0.1559481,0.26662824,0.34524405,0.5048161,-0.1119962,-0.39777836,-0.36185783,0.5821263,0.55294424,0.61992157,0.3035673,0.06427505,-0.34794998,0.22422539,0.59839034,0.18896784,-0.6759302,0.043668654,0.8886161,-0.17720076,0.7715777,-0.39991865,0.25156283,0.69417393,-0.9998098,-0.6787139,0.39948606,-0.34363103,-0.12363999,0.40144488,-0.89757246,0.2606108,-0.34981287,0.36138037,-0.025715616,-0.43154985,0.6456855,0.48682258,-0.2025674,0.99273086,-0.6327563,0.8244681,0.41579178,0.33186653,-0.38865402,0.20334461,0.40388003,-0.44282722,0.8910351,-0.9827425,0.65076685,-0.023986189,-0.048841305,-0.6575315,-0.13323651,-0.51562953,0.096689984,0.22347496,-0.44116366,0.30132815,-0.16113946,0.02791841,0.26800328,0.9869908,0.8037023,0.08999399,0.34818545,0.2399792,0.037739433,0.33968505,0.06571701,0.012683232,-0.19740388,-0.031146497,0.9998846,-0.21947172,0.5299891,0.4033234,-0.28496587,-0.29145885,-0.941137,0.45671248,-0.39640263,0.29572555,-0.37972778,-0.9995764,0.06306565,0.85905,-0.50728047,-0.41093034,-0.1896466,-0.36513484,0.4046653,-0.81958985,0.5621709,0.40369505,-0.87203,0.91930926,0.61741185,0.21568394,-0.52592367,-0.5987447,0.2500671,-0.35882413,-0.75868744,-0.87592685,0.06333643,0.41371068,-0.38985446,0.3858358,0.05091232,0.26858896,-0.565036,-0.009931626,0.36272535,-0.1889833,-0.40049836,-0.1352768,-0.5355889,-0.4352395,-0.99192005,0.890866,0.52554667,0.36645016,0.024259971,-0.19281822,-0.75471085,0.6108296,0.20097034,0.15996367,0.2595225,-0.42033198,-0.26063272,0.173789,0.50320846,-0.81462663,-0.059944738,-0.6169157,-0.42460188,0.05451961,0.33247483,-0.45393863,-0.64464164,0.28272682,-0.4086442,0.070168816,-0.3266667,0.062737875,-0.73320085,-0.4404816,0.6656836,0.024875341,-0.54632366,0.49219242,-0.9999295,-0.4427661,-0.40033984,0.20690002,-0.67267996,0.14490546,-0.6651164,-0.1076784,0.6255772,-0.2769316,-0.8497843,-0.64453834,0.4053195,-0.8076862,-0.7127456,0.98957306,0.19732928,-0.22701965,0.054630335,-0.12276117,0.04372847,0.25064084,-0.8323272,0.27206895,-0.13901204,-0.27039152,0.062529795,-0.7404971,-0.27552795,-0.0284369,0.14483516,0.8562271,0.36093777,0.84480345,-0.6062378,-0.8988383,0.3128776,-0.33278403,-0.038074438,-0.29975694,-0.63152903,-0.22910948,-0.551717,0.3251125,0.43857813,-0.2912614,-0.35198656,0.23368299,0.12926608,-0.22390975,-0.1140909,-0.7871234,0.40125677,0.29084378,-0.43446752,0.5902811,-0.02402605,-0.22892407,-0.7340463,0.00825605,0.30744004,-0.2829437,0.99527955,-0.06221798,-0.40618703,-0.43406352,0.4384855,-0.12337483,-0.6553066,0.44558787,-0.7075783,0.09204134,0.99621594,-0.30193922,0.5170748,-0.16346483,0.36608192,0.5771806,0.8197274,-0.15760934,-0.21854392,-0.41273427,0.935061,0.12609933,-0.038188722,0.5383474,0.55837566,0.99998325,-0.99501926,0.7038729,-0.06547344,0.20572528,-0.38387647,0.18245147,-0.50754327,-0.79115075,-0.98723614,-0.86587334,-0.44627312,-0.29420218,0.4589214,0.40433335,-0.20796138,0.37390643,-0.3506795,0.42175007,0.48173615,0.4334776,-0.07057066,-0.98440796,0.15190761,0.19313024,-0.4125156,0.37948263,-0.54228705,-0.25315368,0.022206385,0.15285988,-0.7570276,-0.14083607,0.31077307,-0.0961478,-0.14517578,0.5229756,-0.23700586,0.04840121,0.68416053,-0.043578137,-0.032241274,0.42889336,0.05257135,-0.07599949,-0.07215778,0.8299277,-0.48019207,-0.16839129,0.8840169,-0.09268843,-0.23921959,-0.044791427,-0.62868935,-0.9511363,-0.14772001,-0.1536276,0.047483932,0.5262494,0.5347887,0.116815,0.9993404,-0.52233654,0.14082198,0.0927473,-0.13489264,-0.23819937,0.7163976,-0.86145574,0.40634874,0.460893,0.48741606,-0.025346888,0.27145955,-0.60464096,-0.5686798,0.5345899,0.42973775,-0.16619778,-0.99990624,0.3707992,0.42496687,-0.08150598,-0.392281,-0.5832849,-0.51000655,0.1183949,-0.32881993,-0.6132995,-0.123079605,-0.27986896,-0.45816705,-0.2638056,-0.900811,0.31317225,-0.022457214,-0.5817781,-0.5398156,-0.4571277,0.3906805,0.3386601,-0.037810218,0.5110827,0.1089347,0.13733281,-0.075385645,-0.48047715,-0.51112103,0.30111602,-0.5223071,-0.5435071,-0.63718426,0.11993064,-0.11407545,0.21776722,-0.6154047,0.118491225,-0.4748963,-0.25497484,-0.2767225,0.9999269,0.6852862,-0.9062675,0.18819432,0.9956299,-0.13692024,0.178609,-0.9994559,0.68759114,-0.41930526,-0.4679381,0.018627224,0.5768189,0.13685825,-0.286776,-0.7667794,-0.34790882,0.16400784,0.6917265,0.50192046,0.30828962,-0.17610382,-0.9998422,0.9999998,-0.44149375,-0.45004243,-0.59496474,0.9709713,-0.000777546,-0.150661,0.9091334,0.36161473,-0.18695438,-0.3196285,0.1446922,-0.26755208,0.012305868,-0.16652851,-0.3056174,-0.3892873,-0.2283124,0.27666578,-0.99960417,-0.44587418,-0.37537703,0.5507057,-0.046410397,0.2021257,-0.9557613,-0.19624522,-0.63856745,0.005640789,0.30545056,0.6228379,-0.037755206,0.0936562,0.06648481,0.6268441,0.35631418,0.25149018,-0.17964855,-0.014276047,0.13698843,-0.05898839,-0.2727918,-0.5505638,-0.95743483,0.612889,-0.014702989,0.73573875,-0.80477345,-0.02349463,0.22334938,-0.9685408,-0.3700734,-0.47848487,-0.2926679,0.9906233,0.4056478,-0.39251414,-0.5305505,0.22924662,0.20455147,0.99995875,-0.06703367,-0.6851568,-0.22056562,-0.23420851,-0.16108909,-0.31135574,-0.99761134,0.39419648,-0.17010006,0.3754113,0.8168694,-0.15030864],
    [208,1,"Cn1c(-c2ccccc2)cc(-c2ccccc2)[n+]1C",-0.6287469,0.15651742,-0.11234975,-0.40762874,0.2976323,-0.27719018,0.012956193,-0.30631685,-0.3482809,0.43468374,-0.6841546,0.037876315,-0.020832289,-0.54345113,-0.72255296,0.54800063,0.09051071,0.5535263,-0.70680565,0.763511,-0.6588983,-0.82436067,0.17798023,0.43422124,0.09502302,0.043230068,0.5233811,0.7852887,0.6005385,0.1817134,-0.13334028,-0.17804651,-0.32449606,-0.5141815,-0.1851379,0.43957785,-0.825749,-0.029478438,0.9869774,-0.892398,-0.9806694,0.18800241,-0.29982436,-0.7713297,0.7998183,-0.9513586,-0.05517941,0.2434781,0.99619305,0.04530037,-0.1440527,-0.05079488,0.12829241,0.001721746,-0.9264942,0.59173447,-0.6479552,0.36103356,-0.86234176,-0.41851714,0.011834219,0.06714604,0.7688178,-0.6199595,0.15584484,0.60317063,-0.28546014,-0.081953794,0.000703938,0.5809063,0.79420877,-0.8383689,0.5697774,-0.79771316,0.6200623,-0.55733037,-0.03254565,0.24473064,-0.28965417,-0.998195,-0.12891877,-0.43503818,-0.92332107,-0.2825157,-0.6030752,-0.7903723,-0.46710658,0.42682803,-0.34004566,0.47470388,-0.48613617,-0.2673178,-0.34580797,0.000171468,0.82879496,0.2907789,0.3329466,-0.47857255,0.37598506,-0.411753,-0.022198815,0.29481363,-0.09867403,0.8742056,-0.89876413,0.23091824,0.5355101,0.10168887,0.9900656,-0.66927004,-0.35815385,0.29699278,0.74278766,0.04582608,-0.41415596,0.8026914,-0.47060475,-0.11399875,0.99770635,0.027391592,0.019691152,-0.42548823,0.001811867,0.22469549,0.075014375,0.070182905,0.07586224,-0.34974858,-0.7227447,0.99985534,-0.61501914,0.17373694,0.22838093,0.009379177,0.7851434,-0.96689796,-0.263733,0.45076057,-0.8275381,-0.46413392,-0.99999005,0.24555624,0.9872766,0.031213125,-0.01727015,0.14561996,0.17379238,0.21193284,-0.17293859,0.110380925,-0.06692398,-0.8371435,0.33915728,0.23913601,-0.08258788,-0.5278567,0.23880835,0.9271979,0.11589275,-0.9184864,-0.97274345,-0.15718801,-0.5600108,0.45092988,0.5937935,-0.19928473,0.6560807,-0.52717626,0.2602467,0.40853292,-0.83233106,-0.018557552,0.1507442,0.68327445,-0.09926894,-0.8301243,-0.61290145,-0.000341201,-0.249926,-0.7897195,0.20383385,0.6948036,0.64134896,-0.07589989,-0.65300775,-0.7161112,0.4860235,-0.32048804,-0.2230418,0.26423636,-0.18598464,0.5176229,-0.14548407,0.6167665,0.30247578,0.432102,-0.6448172,-0.20701241,0.79551405,-0.52521074,0.36662933,0.13816941,-0.75943536,-0.51564974,0.7458416,0.4450993,0.30973187,0.6479804,0.49432942,-0.9996392,-0.008523901,0.1676938,0.38650212,0.4897981,0.40858996,-0.30586833,-0.006550936,-0.23506132,0.112217404,0.4820211,0.04473512,-0.5409353,-0.4272338,-0.49736318,-0.97834617,-0.11158506,-0.40018272,-0.6026009,0.11044064,0.45742697,0.3291483,0.25052914,0.7593775,0.18720616,0.39418775,0.41670907,-0.5912958,0.5121527,-0.11434896,-0.02911074,-0.9767979,0.16994695,0.21133061,0.33354813,0.5678614,-0.6515869,0.113562584,0.50153255,0.5618484,0.21216388,0.061046835,-0.7735951,-0.4148047,0.699585,0.1834066,0.41392404,-0.66872597,0.68192965,0.017297065,-0.74926895,0.64377165,0.22842273,0.08413409,-0.61181486,-0.38073733,-0.077720545,0.057589974,-0.22392485,0.9790786,-0.41301566,0.0542357,0.9556179,-0.15856113,0.68504584,0.5854591,0.04865706,0.63135254,-0.49886006,-0.28635135,-0.065253995,0.4431224,0.99966204,0.59612465,-0.14158246,0.15442422,-0.011381785,-0.38923433,0.8913657,0.9629327,-0.04042516,0.2881212,0.9918697,0.2939083,0.40008292,0.03848137,0.6205705,0.9999978,-0.9927067,0.53820217,-0.69179183,0.16658494,0.30446234,-0.37351805,-0.19661707,0.16526046,-0.73116,0.32682425,0.120391086,0.3328276,0.19972154,-0.3195771,-0.02494315,0.40117303,-0.2823402,0.94094694,-0.5740132,0.4860121,-0.31637454,-0.9999714,0.43981278,0.39723578,0.516201,-0.02399896,0.38860857,-0.7391515,-0.2665487,0.039825097,-0.9220766,-0.20953862,0.3459381,-0.026041845,-0.31359434,0.5669736,-0.14914997,0.022853928,0.78845125,-0.694234,-0.35933274,-0.8550116,0.6231885,-0.010254464,0.2774888,0.55405265,0.07350073,0.096376926,0.18803109,0.20986237,-0.3739099,-0.03614778,0.1021422,-0.9911713,0.7021754,0.06079192,-0.14474194,-0.028633248,-0.39965743,-0.18954304,0.99990374,-0.6223898,-0.16063671,-0.41552925,-0.6220372,-0.50493056,-0.2962288,-0.8549523,-0.41584083,0.09327825,-0.1890928,-0.5677757,-0.6533309,0.4318496,-0.4084137,0.6752094,0.34564167,-0.27290475,-0.98629695,0.3870984,0.12740065,0.19206122,0.19723442,-0.81240857,-0.2577833,-0.2900852,-0.75651366,-0.33577886,0.017827498,0.05291809,0.17729114,0.22765842,0.5332203,0.38487485,-0.13034464,0.15147312,-0.111901,-0.23015606,0.13450155,-0.43792278,-0.31649065,0.77407813,-0.70213544,-0.8875968,-0.11413473,0.25713816,0.20435996,-0.19531502,-0.21191896,-0.41056022,-0.5781454,-0.2458964,-0.37978846,0.54997134,0.11365119,0.14421383,-0.6046851,-0.21566957,0.7310992,0.99999976,0.42837372,-0.9798523,0.64001054,0.9992893,0.51881033,0.25607276,-0.9999472,-0.5957633,-0.28067654,0.56266123,-0.03892459,-0.58617914,0.38144824,-0.58362705,-0.08448826,-0.3665773,-0.31559873,-0.19299653,0.35930392,0.69324976,-0.002376191,-0.99999714,0.9999989,-0.87957954,-0.18133931,-0.30315384,-0.44458154,-0.584212,-0.7520421,-0.7489041,0.6993171,-0.062462177,-0.26022652,-0.88990355,-0.04729819,0.35519665,0.10341239,-0.40455705,0.5088685,-0.4979511,-0.54996765,-0.9999718,0.27962044,-0.34576896,-0.5359411,0.19824724,-0.64855146,-0.9955584,-0.44795495,-0.47030827,-0.3164008,0.043425746,-0.1499697,0.02288784,0.9747575,0.19810848,0.5819901,-0.20609394,0.7301854,0.3177891,-0.56498545,0.5754468,0.22565882,0.01485364,-0.52188647,-0.99623084,0.65884364,0.41004208,0.49842516,0.059191577,0.34340733,-0.43979952,0.7402392,0.7870389,-0.33792466,0.45813864,0.91390467,-0.1276527,-0.27675438,0.108578086,-0.39867464,-0.23895407,0.9998757,0.7507136,-0.06634991,0.33737907,0.4075561,-0.28747338,-0.3792938,-0.97322017,0.16169085,0.9426358,-0.29151008,0.70629114,0.44774738],
    [209,1,"CCCOC(=O)c1ccc(O)cc1",0.44224623,0.005687972,-0.03308245,0.41968372,0.5079395,-0.24521065,-0.44563192,-0.1632297,-0.11650411,0.09043098,-0.43528035,-0.44668075,-0.32550624,-0.71030915,0.26506254,0.56066847,0.13238326,0.11149407,0.15384649,0.003024699,0.40700164,-0.8068831,0.32911664,0.15115844,-0.44745088,0.38466415,0.21521641,-0.060655694,0.25579494,-0.003239106,-0.14369227,-0.03427569,0.09771552,-0.169297,0.15002652,-0.34794524,0.2408728,0.4037466,0.36975142,-0.8952998,-0.9968855,0.12628351,0.013951723,-0.19158454,0.09673147,-0.9931305,0.18228842,-0.14795528,0.9850624,0.1493763,0.60642886,-0.109824784,-0.08775384,0.4093141,-0.82290524,0.29572627,0.10066626,0.9511492,0.35629255,0.18467994,0.012568449,-0.45668498,0.31830722,-0.507821,0.17070204,0.7992398,-0.097332716,0.32810917,0.26189917,-0.164533,0.557539,-0.99562097,0.24052729,0.27264386,0.48800248,0.6506018,-0.568533,0.02150101,-0.205283,-0.99929136,-0.7280899,0.12910526,-0.8515933,-0.45503756,0.35428885,0.36309844,-0.005843872,-0.076871954,-0.37205732,-0.5585957,-0.20388882,-0.3454565,-0.25378087,0.103746496,0.9778598,-0.18397242,-0.13554114,0.036472145,-0.053648695,0.18633696,-0.07732569,-0.10808864,-0.18091275,0.147471,0.84106594,-0.55663985,0.45983607,0.19512953,-0.9004488,0.5684493,0.45410714,-0.28481624,-0.37799415,0.01588213,-0.08191575,0.20109728,-0.26332998,0.4202455,0.9991384,0.13723534,0.044572152,-0.09498939,-0.09671796,0.3412118,-0.54811585,-0.18109936,-0.11594943,-0.5010911,-0.35821855,0.9974423,0.13594785,-0.023061452,-0.42537984,0.18580794,-0.43474382,-0.5498219,0.2786264,0.2914924,-0.56363994,-0.35667205,-0.9965397,0.004875066,0.9675247,0.3790519,-0.30414534,-0.22884436,0.21105018,-0.25903282,0.98644733,0.31420287,0.15034689,-0.6990142,0.092084385,-0.12536773,-0.31327078,0.20627174,0.20665158,0.99846745,-0.34913084,-0.7460267,-0.9924106,0.058506697,-0.30378333,0.40429193,-0.23489298,0.16914724,0.087597325,0.4297928,-0.23019747,-0.20209542,-0.24851891,-0.023989998,0.5566481,-0.3828781,0.061204813,-0.97007364,-0.6950741,0.26607418,-0.6544756,-0.327589,0.62756217,-0.86350775,0.42270172,0.23817767,-0.8564775,0.118677765,0.6588398,0.1184067,-0.32332715,-0.30002946,0.23337288,-0.16948365,0.058397457,0.1021289,0.072568625,-0.3456085,0.23690219,-0.6666755,0.24690664,0.19169886,-0.4617994,-0.50499576,-0.021236412,0.3472503,0.267162,-0.34165755,0.40094104,-0.20184699,-0.15441096,-0.97064745,-0.48093686,-0.19062294,0.47859544,-0.43203017,0.09991068,0.35519704,-0.1861273,-0.121651985,0.02379746,-0.15600765,-0.17309216,-0.2639032,0.122288235,-0.2891421,0.9993218,0.013274292,0.10955332,0.35286465,-0.28925812,0.10634725,-0.11514471,0.05165229,0.39442915,-0.08352643,0.071619,-0.24940945,-0.20195216,-0.31018272,0.30946434,0.4539672,0.9042012,0.10084234,0.38847774,-0.6080672,0.3127191,-0.088306665,0.16911732,0.37210497,-0.43770158,-0.13046055,0.10627754,-0.9976873,-0.29295814,0.51688915,0.07532912,-0.39154455,-0.40815696,0.36115786,0.43708748,0.24933821,-0.07464009,0.54145926,0.117871545,-0.32457262,0.4296225,0.080042966,0.5373665,0.40478182,-0.47251156,-0.027701113,-0.29088348,-0.5951334,0.14650059,-0.27126008,-0.17457257,-0.14932412,0.32508054,0.37214723,-0.44156316,0.7327933,-0.17585328,0.9995075,-0.25593746,0.22680376,-0.20625097,0.041450586,0.09551535,-0.6398882,0.424576,-0.030414015,0.42274576,0.99946517,-0.55157745,0.72336274,0.006453786,0.40215462,0.9982361,-0.8085193,0.18509802,0.40392065,-0.20470946,0.33450222,-0.24350265,0.09842954,-0.44422218,-0.5027197,0.98993343,0.20957363,0.14387381,-0.035692714,-0.17460933,0.13622399,-0.12759733,-0.49072987,0.36989835,0.10025439,-0.39979294,-0.32749867,-0.97604805,-0.59207475,-0.008740664,0.31780505,0.20150892,-0.81609976,0.1193859,-0.16608329,-0.08923547,-0.8762452,0.37768304,0.032244388,-0.036239173,-0.21777877,-0.101531126,-0.118311666,-0.10240692,-0.6311904,0.31433806,0.086798005,0.24848936,-0.4328977,0.2038388,0.24478538,-0.08033276,0.8182136,-0.117615074,-0.22569154,-0.16205765,-0.05233903,-0.34104097,0.90758413,-0.9952515,0.43881947,-0.28598654,-0.14237611,-0.01571991,0.014142815,0.6219075,0.9983248,0.3677757,0.23703994,-0.026204888,0.5014111,0.45262796,-0.36465433,-0.5679691,0.29242998,-0.07837986,-0.4780665,0.35283536,0.44014272,0.001733887,0.21595427,-0.35536873,0.91671324,0.64101094,1,0.23979546,0.43555266,0.16552727,-0.36452532,-0.8130127,-0.49037966,0.121498555,-0.13530436,0.34577677,-0.30982304,0.6184617,0.37126806,0.42684594,0.5897451,0.019279886,0.043292247,-0.1512129,-0.62501335,-0.24935561,-0.43485248,0.03127636,0.018974539,0.3230724,0.56564623,-0.5329517,0.32851547,-0.1453502,0.11064362,-0.25501496,-0.30061305,-0.3750231,0.002887365,-0.26876795,-0.3696841,-0.3319271,-0.035015598,-0.40615338,-0.22515777,0.59704053,-0.16587158,0.9999464,-0.41326016,-0.97838026,0.03829274,0.9993918,-0.2692634,-0.5253004,-0.9975117,-0.14797366,-0.003596935,0.26086548,-0.17732112,-0.14792234,0.49904126,0.078993246,0.5889271,0.4591318,0.3010382,-0.36479613,0.29668707,-0.089462884,-0.16982903,-0.9999405,-0.9991389,-0.9871803,0.4148243,0.16735865,0.16736665,-0.05278256,-0.39880183,-0.56239957,-0.4241379,-0.23028381,0.32156542,-0.8230334,-0.40859795,0.01670997,-0.7027377,0.6011069,0.012306887,-0.02567166,-0.98092383,-0.99990785,-0.44779783,-0.54609436,0.08199554,0.3091142,0.1336519,-0.92254865,0.25756818,-0.2725337,0.19476591,-0.6257841,-0.046298414,-0.23248605,0.9512124,0.099407785,0.79238,0.23844308,0.5546043,-0.3772108,-0.5512721,-0.35063493,-0.19766109,-0.3392309,0.5641254,-0.007396348,-0.20026791,-0.38488787,-0.5546347,-0.0712448,-0.57567364,0.34873402,0.3847507,-0.61772776,0.15745653,0.252822,-0.6515695,0.3347507,-0.54931104,0.202927,0.15770462,0.38617733,0.99991924,0.13490453,0.3414007,-0.4707613,0.54507554,-0.15660192,-0.06262439,0.02141431,-0.34305182,-0.028628284,-0.39289656,0.43178812,-0.27308983],
    [210,1,"CCC(=O)OC1CCC2C3CC=C4CC(=O)CCC4(C)C3CCC12C",0.43165916,0.057623614,-0.49248362,0.09755743,-0.051343102,0.35458753,0.33156615,0.31864163,-0.3024708,0.38776228,-0.080876246,0.30955127,-0.3171727,0.21827812,0.004682078,0.25442007,0.2246245,-0.5848651,-0.41072926,-0.21954936,0.10770926,-0.3265609,-0.702784,-0.2712557,-0.33537135,0.49344984,-0.54168725,-0.63287914,-0.16877909,-0.34990183,-0.65989006,0.15440479,0.5415149,-0.25988615,-0.098169126,-0.2635998,0.73614347,-0.21082021,0.99949175,-0.02277092,-0.40811548,0.1849542,-0.4297177,0.43449444,-0.023630315,0.17908506,0.6853129,-0.34374112,0.99453264,-0.27650994,0.1269932,0.38892227,-0.5048706,0.20256671,-0.76831406,0.32606524,0.33081368,-0.30515346,0.55246717,-0.2719041,-0.031159269,0.48199224,0.533115,0.2175076,0.5131521,-0.21160512,0.27717537,-0.596405,0.6346202,0.39418292,0.042758785,-0.4779632,-0.3530322,0.88674885,-0.08544471,0.81501764,-0.6642717,0.06358142,0.7335081,-0.9999427,0.22641881,0.08709568,-0.79351443,-0.48291963,0.3961731,-0.91324073,0.33654696,-0.38542452,-0.19500427,0.5193108,-0.4574543,0.73998994,-0.2108939,0.2634051,0.9971297,-0.58394974,0.7364904,-0.22621657,-0.29855058,-0.6304872,-0.21584111,0.3891573,-0.32370657,0.88501513,-0.9987121,0.22197656,-0.003854814,0.49985072,0.96028405,-0.08408072,-0.040875055,0.23766051,0.5009064,-0.47870883,-0.2734258,-0.04411318,-0.36589167,0.57775426,0.9432785,0.53696626,0.12461268,0.3471771,0.031455956,-0.16653965,0.46925533,-0.27544996,0.35982394,-0.10890591,0.00045828,0.9999036,0.010961439,0.42609677,0.44734663,0.25642493,-0.3788206,-0.9903069,0.330903,-0.035715982,0.42612645,-0.52543557,-0.9995294,-0.59446263,0.5881215,-0.20481987,-0.012579366,-0.5430475,-0.10815899,0.75842345,-0.993736,0.53705806,0.2618177,-0.91342556,0.91673344,0.6825896,-0.24843666,0.21404198,-0.52393144,-0.82379013,-0.47922143,-0.9418772,-0.64061725,0.005861569,-0.1771984,-0.06996605,-0.35550594,0.5260727,0.30455798,-0.5793156,-0.22196585,0.3347115,-0.577359,-0.34392038,0.39442047,-0.34125337,0.11581107,-0.97370505,0.8559517,0.24512161,0.009100258,0.084202826,-0.32434002,-0.90252405,0.4002661,-0.6141468,0.4647577,-0.16889623,0.05512872,-0.39819905,0.12753269,0.5758421,-0.8940027,-0.013220017,-0.5036703,-0.58716166,-0.09754751,-0.08710786,-0.42107892,-0.9233294,0.49631616,-0.1878506,0.22521657,-0.18123043,0.5149102,-0.648469,-0.2756797,0.2890248,0.16758272,-0.7695379,0.20369793,-0.9999629,0.21950196,-0.3111904,0.089693576,-0.62272036,0.02992111,-0.15218347,0.20793176,0.17346132,-0.27686408,-0.7072742,-0.37544617,0.47448134,-0.7492256,-0.47180822,-0.94423306,0.35993478,-0.043587215,0.1563357,-0.1779462,-0.15423696,0.44540352,-0.81633353,-0.23707514,-0.20474228,-0.05434926,0.48623407,-0.13981247,-0.47762817,-0.22202444,-0.4181882,0.9202095,0.562717,0.800852,-0.32326978,-0.85236424,-0.2233126,-0.5314717,0.14492166,0.08742295,-0.4059022,0.18478483,-0.43376508,0.1899024,0.6605732,-0.30295894,-0.4933825,0.32117933,0.24236014,-0.74201614,0.3138769,-0.52940506,-0.07020649,-0.33832288,-0.6226628,0.8588859,0.002516581,-0.4722579,0.09659652,0.9532394,0.38590226,0.049466066,0.99930215,0.32189247,-0.4805485,-0.4931675,-0.63741064,0.028489223,-0.7812428,0.602929,-0.49499318,0.27816945,0.98994607,-0.12207726,-0.09282945,-0.5273829,0.3211974,0.37940842,0.93735945,0.3989678,0.22301295,-0.31221068,0.55384845,-0.020224178,0.36698672,0.5280975,0.65898305,0.99998814,-0.9953702,0.59404486,-0.26278484,0.17127675,-0.15468067,-0.04747192,-0.5854933,-0.79716563,-0.98926777,-0.9899671,-0.37434053,-0.13890019,0.52776945,0.24521804,0.003704683,-0.042243727,-0.7221924,0.038379967,0.48927134,0.25874522,-0.18132925,-0.99985856,0.19927716,0.56695664,-0.15421738,0.41181064,-0.76396954,0.10293968,-0.020882212,0.062831774,-0.83259743,0.49059433,0.45044312,-0.21017203,-0.71862155,0.43707094,0.003649687,0.30487233,0.74642086,-0.055111144,0.13522337,0.5412402,0.42839637,0.69040185,0.10041655,0.7866047,-0.053966183,-0.03557065,0.61992425,-0.2737842,-0.07187391,0.25900853,-0.9277737,-0.8226283,0.18441492,-0.02383877,0.2777637,0.548355,-0.06859243,-0.22777212,0.9992292,0.3920574,-0.113874115,0.4608161,-0.07938259,0.51118755,0.7150972,-0.9032968,0.4285253,0.50883824,0.40317887,0.26362398,0.7080206,-0.75712264,-0.26392278,0.23777783,-0.16401654,0.4859429,-0.9999531,0.1638364,0.009091957,0.35975268,-0.27648476,-0.20902447,-0.29147178,0.18578346,-0.111712545,0.40979165,0.050176125,-0.010243892,0.001873383,-0.10464905,-0.8556888,0.5029474,-0.08380472,-0.5233094,-0.7212528,-0.45762974,0.25916454,0.43750644,-0.48629862,0.43421003,0.009292969,0.58199984,0.3914256,-0.4357542,-0.2960648,-0.07903583,-0.33622628,-0.44852588,-0.44906792,-0.13697968,-0.1445001,-0.24885596,-0.48667142,-0.051091846,-0.4103926,0.2853969,0.3332854,0.99999917,0.43467835,-0.97758776,-0.007596562,0.9973918,-0.10665942,-0.33063743,-0.99994254,0.568617,-0.7201742,-0.3677149,0.39261392,0.10779812,0.6828587,0.09928927,-0.79281753,0.060292184,0.15823792,0.72355306,0.39259455,0.4486936,0.019339014,-0.999842,0.9999998,0.2917723,-0.40561497,-0.18781757,0.7882758,0.19194235,0.33214125,0.9035338,0.10604691,-0.48123488,-0.35798323,-0.3019898,0.22546798,0.60453457,-0.4424739,0.13497925,-0.32550794,-0.20294139,0.82369107,-0.9991054,-0.38951653,-0.16106364,0.54832757,0.1531301,0.347611,-0.8258285,0.006981862,-0.013495318,0.40134507,-0.47281647,0.6708381,0.048858594,0.3980587,-0.38296,0.63530344,0.33619606,-0.073226765,0.14546226,0.5109246,0.20264108,0.05835167,-0.37545586,-0.7479309,-0.9921327,0.4396179,0.060677297,0.5597995,-0.70981675,-0.002253437,0.16099484,-0.9645615,-0.08565354,-0.36236045,0.08359779,0.9988506,0.6453048,-0.26910427,-0.44135195,0.2854666,0.62923205,0.99998,0.15499355,-0.16819233,-0.30557954,0.44682643,-0.3724612,-0.27641302,-0.99932873,0.6281277,-0.1386868,0.35179615,0.77634597,0.04729811],
    [211,0,"COc1cc(-c2ccc(N)c(OC)c2)ccc1N",-0.5069335,0.5031547,0.5219389,-0.6412298,0.13183352,-0.08690749,-0.16269733,0.082574725,-0.3152213,0.45548117,-0.806037,-0.0951456,-0.36128604,0.19415714,0.25753695,0.18727306,-0.14604865,0.051367667,-0.20754747,0.1428663,0.081679076,-0.47946224,0.7945335,0.17038187,0.65790194,-0.6009661,-0.20685259,0.47247145,-0.388762,-0.06339218,0.22491498,0.020082073,-0.10111714,-0.22710551,-0.5077882,-0.24213882,-0.36655247,0.57802784,0.9846941,-0.79303324,-0.44119558,-0.1864595,-0.7906962,-0.33628896,0.25759068,-0.95051146,-0.2677058,0.4466558,-0.02290429,0.49441206,0.28714567,0.29914746,0.043979757,0.087505594,-0.8860652,-0.4292328,-0.7600047,0.56322753,0.3671159,0.11670178,0.40927738,0.09258557,0.3276004,-0.4653521,0.46898988,0.7120267,-0.3547911,0.18221106,0.27082425,0.08908179,-0.6268351,-0.9768985,0.4037719,-0.7014328,0.13335724,-0.27239,-0.21181728,-0.23086952,0.2534231,-0.9873519,-0.43353704,-0.11017228,-0.9172386,-0.09715385,0.35763675,-0.5313272,-0.5144792,0.049019035,-0.23913924,-0.7589001,0.2884801,-0.102890134,0.29376435,0.22300428,0.9825215,-0.29550028,0.28439814,0.029570434,0.6465933,0.049792632,-0.018846031,-0.64229935,0.21835218,0.43355,-0.7418837,-0.6566826,0.1188078,-0.034867804,-0.9992113,-0.02252918,-0.22911982,-0.36677778,0.037154276,0.49772862,-0.5700846,-0.5573003,-0.45820013,0.2237876,0.9977637,-0.31730404,-0.3198551,-0.72450197,-0.035031024,-0.34919545,-0.28003645,-0.044754513,-0.3230072,0.049730357,-0.45410496,0.99881065,-0.5439785,-0.038921718,-0.05457306,0.17540683,-0.1521961,-0.2496305,0.2915801,0.4846253,-0.68156123,-0.24119343,-0.99918914,0.09717672,0.93666506,-0.099212326,0.16969834,-0.10450091,-0.008977531,-0.4820398,0.52992195,-0.3708691,0.49607697,-0.62032616,-0.6447157,-0.011299336,-0.20164977,0.19568296,-0.48201352,0.9368497,-0.67225826,-0.06010458,-0.96592253,0.580369,0.39439508,-0.10924444,-0.02709616,0.5088204,0.44370484,-0.31904984,-0.042842355,-0.09090023,-0.76648396,0.106948026,0.09030025,-0.5144733,-0.44747582,-0.863209,-0.7864571,-0.19934876,-0.6561352,0.1757942,0.020782435,-0.9132102,-0.03322488,0.44287816,0.17744498,-0.38084292,0.4042832,-0.20699225,0.3961865,0.30791423,0.82134676,0.3496794,-0.18402292,-0.39389178,0.25156552,0.09313088,-0.41227263,0.34869885,0.17771836,-0.39986438,-0.39145118,-0.48487762,0.19469011,-0.30476144,0.51861966,-0.2967213,0.21351673,-0.22683097,0.6782505,-0.9993282,-0.07298546,-0.45497635,0.39071164,-0.2695481,0.001992163,0.46419704,0.22010234,0.03141035,0.10191878,0.24169032,-0.007953247,-0.56413674,-0.3811942,0.38800803,0.9999804,-0.1528303,-0.0585024,0.15276174,0.04231349,-0.10116923,-0.15013146,-0.45878315,0.5539852,-0.33353305,-0.20566016,-0.20944825,-0.45266607,-0.12579395,0.022143904,0.6777174,0.8930289,0.28536686,0.55339366,0.07881061,0.7564546,-0.19739987,-0.011751639,0.40610084,0.0241514,-0.48429075,-0.24586834,-0.9780139,0.7053372,-0.14680053,-0.26383767,0.46686953,0.4441494,-0.17037617,0.3747912,0.06416362,-0.36437878,0.51550615,0.46254292,-0.70198196,0.67774856,0.13787286,0.099465415,0.2783657,-0.99762636,-0.05005232,0.33571678,0.91402227,-0.3409466,0.7330444,-0.5300065,-0.49751872,-0.16543004,0.6045322,0.5044667,0.6108033,0.02730121,0.99888897,0.1664246,0.33807877,0.15126747,-0.2684837,-0.06679357,-0.24284056,-0.34188542,-0.27454248,0.35566774,0.99403906,-0.032758094,0.81342274,-0.17220068,0.12758082,0.9998829,-0.960551,0.021393692,-0.37828475,-0.5360587,0.14404379,-0.7475621,0.24820861,0.4260942,-0.7549357,0.17611633,0.007567457,0.13844597,0.5498155,0.35254508,-0.08489069,0.5425856,-0.65454674,0.41202328,-0.44035432,-0.20464312,-0.64145553,0.83538544,0.5870548,0.15435949,0.08458946,0.1820709,-0.4657393,-0.1045668,0.17465894,0.54392415,-0.6421512,-0.22327559,-0.5802874,0.34820685,-0.4812327,-0.09124112,0.03236582,-0.5494836,-0.16962071,0.13397953,0.14043823,-0.23276463,0.40595657,0.06486009,0.3442666,-0.628967,-0.35192752,0.37726343,0.10205662,-0.039508186,-0.029399002,-0.33211404,0.35463244,-0.98266083,-0.1448235,-0.2184343,-0.15291929,-0.09561172,0.63711894,-0.019473104,0.99960566,0.7069341,0.28177726,-0.18328197,0.02976041,0.41870672,-0.28211996,-0.758918,-0.23460424,-0.6649643,0.028831271,-0.32921252,0.30449265,0.525629,0.22890262,0.5857372,0.3860815,-0.100316666,0.9985639,-0.3707265,-0.048269313,0.19352168,0.6055632,-0.47223142,-0.7540645,-0.36492437,-0.49934095,-0.40998235,-0.54201734,0.12201177,-0.4392876,-0.46371543,0.69131726,-0.05594758,0.22503494,0.48996025,0.16671556,0.040720116,-0.36582506,0.2526081,0.021746315,0.74329835,0.51959026,-0.1923761,-0.2762487,-0.003143645,-0.22803624,0.019593451,-0.2489092,0.051503576,-0.813516,-0.6461835,0.2925558,-0.29737929,0.4311232,-0.05896763,-0.65677524,0.25821576,0.34966096,0.9793923,0.18982284,-0.9773747,-0.19948342,0.9994901,0.5312488,-0.23115575,-0.98517,0.06768607,0.30146325,0.63338774,0.10094057,-0.39472517,-0.20067127,-0.6983663,0.10574611,-0.40845618,0.07653429,-0.16009063,-0.49179125,0.25108,-0.4018902,-0.99995947,0.9904049,-0.9484793,-0.54257005,-0.4943631,0.25218266,-0.025563413,-0.6398442,-0.62137395,0.51679814,0.2530146,-0.097606204,-0.9190355,0.43094528,0.44098067,-0.56702185,0.80632406,-0.47821093,-0.15045471,-0.5934331,-0.9998935,0.01340088,0.37434763,0.08452794,-0.14774632,-0.22767183,-0.76040655,0.6718839,0.62946576,-0.42529854,-0.1956156,-0.40783012,-0.20101482,0.9590876,-0.48780102,0.42096552,-0.5631751,0.4842293,0.57340026,-0.67437476,0.24002716,0.44414136,0.2722084,0.6365989,0.1284334,0.5843279,-0.05416939,0.055470545,0.11284921,0.11715789,0.06506708,0.7415152,0.25490534,0.5865724,0.1175114,0.8974775,0.15122883,0.038348276,-0.10113654,-0.6409717,0.42755818,0.9997582,0.71384096,0.07052903,-0.41284013,0.34191623,-0.013905949,-0.24160218,-0.966499,-0.1200248,-0.3136318,-0.2574194,0.07598713,-0.63687044],
    [212,0,"CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C#N)cc2F)cc1",0.6483443,0.33550915,0.064654864,-0.2342759,0.5162002,-0.6488855,-0.6925772,-0.28106242,-0.4388578,0.37909278,0.067680426,0.19409268,-0.002354056,-0.20941834,-0.0320697,-0.29155332,0.21273963,-0.31378913,0.36924896,-0.49810758,0.6533212,-0.28730085,-0.40972376,-0.091960296,-0.34674433,0.26667386,-0.06934813,0.23049046,-0.26265973,0.6551567,-0.15360005,0.0887493,0.38337082,-0.6280734,0.3112324,-0.39566892,-0.24970388,0.5396969,0.9990177,-0.39713627,-0.81192404,-0.06927006,-0.23705961,0.4897903,0.021464605,0.2032172,-0.035758384,0.16091484,0.93883854,-0.35919344,0.91012454,0.3988115,-0.8289175,0.72233814,-0.10614516,-0.051917057,0.42035574,-0.45178297,0.6646748,-0.41140315,0.097292446,-0.09182645,-0.1505115,0.06326653,-0.47406083,0.5390523,0.07378395,0.31053928,-0.24434917,0.024326505,-0.4386392,-0.75997686,-0.5715474,-0.5975264,0.68000466,0.45351842,-0.3357244,-0.2409346,-0.48051727,-0.9996398,0.6257038,-0.33751574,-0.943573,-0.311829,-0.236833,-0.92547715,-0.30321106,0.09248575,-0.20373213,-0.55678236,-0.37870935,0.43189073,-0.44390595,0.65590984,0.99863404,-0.20915848,0.32010663,-0.5978487,-0.53592956,0.45079744,0.014206561,-0.18637165,0.5110351,0.9766387,-0.996031,-0.8999885,0.12608595,0.49637893,0.97309214,-0.061519675,0.46848583,-0.6155187,0.05853531,0.84992844,0.1854839,0.48809657,0.45747444,0.40236342,0.9659149,0.18943882,0.28722847,0.6723644,0.24094859,0.19802265,-0.23495075,0.30217794,-0.07185988,-0.6686906,0.6413955,0.99965924,-0.21597916,-0.54990923,0.29293728,0.45477545,-0.49648872,-0.9949201,-0.7866073,-0.30331033,-0.3481875,-0.22646391,-0.9998805,0.5308738,0.5331549,-0.43994802,-0.24363707,0.6299806,-0.27349153,-0.16094166,-0.96975833,0.4401758,0.55370736,-0.81031287,0.39303112,0.1566273,-0.08277227,0.50190955,0.32744294,-0.24901474,-0.5916506,-0.94900465,-0.6386193,-0.5749937,-0.1933224,0.4184629,-0.54359365,-0.04882925,-0.35756204,-0.3221767,-0.01602155,0.54769975,0.55405635,-0.24262494,0.11998936,0.12905838,0.51140946,-0.8268064,-0.46488696,0.10443579,-0.5501777,-0.11295899,0.41229877,-0.97020817,-0.100416094,-0.27948263,0.49479666,-0.48906767,0.40438643,0.14666566,-0.35318464,-0.25295663,-0.65151453,-0.6770558,-0.6997184,0.0582373,0.5028657,-0.17429529,-0.20239456,-0.78535306,0.21168911,0.3594498,0.046023604,-0.78527504,0.39846602,0.30664736,0.664283,-0.66746455,-0.12417051,-0.5243685,-0.34231997,-0.9999222,-0.21997142,-0.027205456,0.44549924,-0.1659304,0.21491863,0.6941255,-0.15141048,0.02920995,-0.14088157,-0.21347521,0.2267577,0.4062308,-0.23570988,0.40649694,-0.9840427,0.52957904,0.6175964,0.16333318,-0.25511515,0.36427715,0.048082028,-0.1946291,-0.38631874,0.34278572,0.3983805,0.048181117,0.101197585,0.060002655,0.75324047,0.27456447,0.8956737,0.47095335,0.27909946,-0.46453908,0.65014714,-0.122959055,0.47883737,0.3335765,0.084814414,0.62606156,0.31045756,-0.96751285,0.14351046,0.7632554,-0.67130977,0.2217597,0.009622619,0.3399538,-0.32054922,-0.321183,-0.053620305,-0.4015129,-0.3166382,-0.67684966,0.5995156,0.5597023,0.28752264,0.3320118,0.9509417,-0.03545174,0.18190041,0.99736685,0.29291967,-0.43827948,-0.444061,-0.48315477,-0.20517574,-0.4665825,-0.2289132,0.29702497,-0.4497689,0.99384344,-0.2926342,0.046740532,-0.75331956,0.3543652,0.49313593,0.83014596,0.5668459,0.7252459,0.15065189,0.80819035,-0.3932389,0.29991704,0.0173907,-0.19244976,0.999933,-0.9723695,0.2957121,0.19021374,-0.0143331,-0.011660457,-0.59509903,-0.123013794,-0.5490701,-0.761373,-0.98790824,-0.013402627,0.8453243,0.26258802,-0.3572533,0.755434,-0.389198,-0.30087602,-0.06918281,0.56817615,-0.27824068,0.40526646,-0.99987346,-0.28045964,-0.08189659,-0.63664865,0.46169117,-0.79297036,0.3826487,0.58318126,0.35977107,-0.7366017,-0.30289546,-0.3313066,0.043030847,-0.6049576,-0.32392207,0.8091698,-0.17557064,0.49169543,0.670163,0.18984672,0.68497765,-0.03826877,-0.27796227,0.29847765,0.07168894,0.4596408,-0.05626125,-0.4119822,-0.38121375,0.6565925,-0.016507095,-0.86780167,-0.8927178,0.6662462,0.6276985,-0.18249965,-0.16359556,0.28971016,0.478064,0.9997263,0.5851662,0.44367504,-0.20574993,0.48677558,0.6443172,-0.5450963,-0.8926614,-0.12232303,-0.5908217,-0.39456946,0.38721466,0.05526486,-0.21376212,0.11316878,-0.505873,-0.23933329,-0.14629416,0.9873556,0.109406345,-0.14284281,0.73133093,-0.13570945,0.397811,-0.4406432,-0.038458146,-0.17263177,0.52364504,-0.48117423,0.49281037,0.4450967,-0.058808744,0.40165466,0.54586244,-0.19013366,0.31882465,-0.21330877,0.2036443,-0.3097554,-0.1362814,-0.05189719,-0.74740815,-0.20722023,0.83668196,0.602803,-0.012522655,0.4261511,0.28079155,-0.74894446,-0.24807136,0.106178164,0.480529,0.36522087,-0.68550247,-0.2586467,0.2567357,-0.015149558,0.81587857,0.07936368,0.9999997,-0.29273742,-0.9222712,0.15724672,0.999656,-0.30862358,0.22612673,-0.99992806,0.107511714,-0.9439858,0.47936642,-0.09621317,0.606268,0.1449055,-0.13176394,-0.43590912,0.16548973,0.7555693,0.4081276,-0.12208741,0.2561369,-0.19374754,-0.9999169,0.99845296,0.24377276,0.45651394,-0.12179385,-0.5627452,-0.4508287,-0.3725936,0.36795858,-0.4570923,-0.3789003,0.47221315,-0.9160708,0.01104254,-0.070501186,-0.2776643,0.45910862,0.5657333,-0.029717414,0.78330135,-0.99952924,0.3605605,-0.573982,-0.025586832,0.29059538,0.24269417,-0.6456991,0.7971647,0.46358156,0.23505895,-0.26155743,-0.6060758,0.28110728,0.9758844,0.0455922,0.07645353,0.3183353,0.37039804,-0.30137372,0.31920138,-0.6595105,-0.59634703,0.17593439,0.095126465,-0.74907774,-0.4123666,-0.16396548,-0.30240953,0.1661419,-0.4391927,0.48925972,0.5318329,-0.5694871,0.5848638,-0.40180025,0.9981659,-0.03000505,-0.17986305,-0.05398612,0.3271938,0.03449816,0.99998957,0.48686707,0.6253015,-0.36755964,0.13548464,-0.4997008,-0.43528438,-0.99673444,-0.4064981,0.46507475,0.14997938,0.124459416,-0.061669342],
    [213,1,"CCC(=O)Nc1ccc(Cl)c(Cl)c1",-0.8695978,-0.11551371,-0.28361848,0.30278745,-0.13094205,-0.6233598,-0.15500157,0.053190663,-0.12975892,-0.3847295,-0.67916054,-0.14042793,-0.25549492,-0.56226087,0.65600336,-0.41409168,0.15129027,-0.5752004,0.27289948,0.034210622,0.6246949,-0.7404027,0.3054027,-0.25831407,-0.29493544,0.6103204,0.35607287,0.01624322,0.20019689,-0.6331743,-0.12527177,0.6160463,0.22832929,-0.28615332,0.27074155,-0.56140006,0.40874577,0.45985037,0.483713,-0.9313304,-0.997695,-0.37286922,-0.3804397,-0.04789211,0.4574117,-0.99586105,0.39287817,-0.02991692,0.92227286,0.03882051,0.06613855,0.16893281,-0.13620034,-0.080631666,-0.9061771,0.4143278,-0.5622065,0.9294892,0.4165438,0.3373848,-0.26406175,-0.38056543,0.3279712,-0.11121017,0.2741164,0.500628,0.39545482,0.598565,0.26347986,0.08411777,-0.352889,-0.9503245,0.19926749,-0.004954223,0.6973499,-0.008185224,-0.25455755,0.21755332,0.2580282,-0.99848074,-0.59015715,-0.37205145,-0.84280145,0.4289215,0.53277516,-0.41008937,0.30804092,0.16486365,-0.2449292,-0.5567846,0.003210194,0.3571053,0.3683625,0.07303144,0.8795725,-0.54935336,0.45345023,0.39472902,0.074050866,-0.5229484,0.34766582,-0.32837287,0.3876462,0.15537593,0.82546824,-0.112604424,0.045268677,0.08590883,-0.90833753,-0.014875331,-0.0696897,-0.013656467,-0.1559458,-0.3987917,-0.27350268,0.11787914,0.14918515,0.45476606,0.99944377,-0.0937716,0.13075288,0.30405957,-0.38454932,-0.36972493,-0.13264474,-0.25457075,0.058791805,-0.42213032,-0.2808349,0.9997948,0.4861059,0.24783818,0.23516686,-0.042463135,-0.007029723,-0.8949067,0.18561764,0.45577905,-0.65793455,0.53889203,-0.98947793,0.34405786,0.9900796,0.15196756,-0.25320697,0.062129926,0.239998,0.091226995,0.9892129,-0.094114006,-0.41161704,0.6221399,0.23204005,0.1888895,-0.3296767,0.2997481,-0.3235695,0.9985148,-0.3546759,0.29828832,-0.9908698,-0.10364341,-0.019968722,-0.23068228,0.08348123,0.4601119,0.3555359,-0.46457607,-0.5782262,-0.11713596,-0.5934354,-0.18388042,0.54996836,-0.010661338,0.24904023,-0.9604488,-0.8115311,0.15812393,-0.35999253,0.028343035,0.06389784,-0.13653763,0.06404835,0.13702267,-0.94788754,-0.5442412,0.4700807,0.12191216,-0.1323569,-0.110915184,0.015619254,0.22462122,0.101934545,-0.048221145,0.06681995,0.116784036,-0.037173636,-0.87198174,0.30320314,0.4761383,-0.5116287,-0.049210228,-0.089105204,-0.14512919,0.2832773,-0.6415937,0.35793033,-0.06554365,-0.24722683,-0.9657461,0.22758684,-0.016303621,0.19648048,-0.5709009,-0.26415977,0.27633497,-0.22490169,0.19023454,-0.30175006,-0.038345627,0.49757487,-0.4053801,-0.415242,-0.61519337,-0.8628529,0.004101765,-0.07360617,0.02472833,0.28369796,-0.18839408,-0.40803698,-0.47596204,0.08859796,-0.6172924,0.2435258,-0.14396858,0.26704162,0.029294873,-0.4944301,-0.07018735,0.8912084,0.55735713,0.33682236,-0.4754464,0.5108279,-0.18889824,-0.02995595,0.19923678,0.15348475,0.003982711,0.6050257,-0.99849194,0.006634316,0.40399915,-0.35334802,-0.18739554,-0.39848056,0.40459356,-0.2660623,-0.07129186,-0.38648838,0.46603078,-0.35234687,-0.52965015,0.8557442,-0.36995423,0.026159815,0.35406208,0.2129819,0.13791244,-0.171744,-0.5359975,0.22958632,0.32676384,-0.16507944,-0.26286295,0.21277785,0.12824735,0.27792215,0.32653287,0.12870994,0.9997147,0.11103821,0.2521452,0.30844522,-0.09363576,-0.4177339,-0.24434619,-0.62456715,0.33045432,-0.20336473,0.9995051,-0.5021738,0.73048645,0.23031084,0.20549242,0.9969045,-0.97175974,0.12194327,0.4132759,-0.050936043,0.08715122,-0.21445118,0.29741463,0.14372379,-0.39706343,0.9925608,0.6540381,0.19661734,0.095865384,-0.120756544,0.13272688,0.048078876,-0.19454321,0.82682556,-0.38874432,-0.29834422,-0.069098234,-0.97777236,-0.010571304,-0.16621967,0.25042665,0.13986754,-0.605843,-0.5162506,-0.43606916,0.55557555,-0.9776379,0.59102803,0.23393929,-0.32989237,-0.6347825,-0.18852709,-0.15460296,0.531448,0.3426154,0.3288486,0.4117473,0.09922241,0.3514499,0.39502987,-0.15509072,-0.23479557,0.5546558,-0.3859782,0.39197865,-0.55333024,0.18539633,-0.077746265,0.82732934,-0.9972237,-0.3744171,-0.21572438,-0.48974776,0.027751079,-0.062614694,0.3130301,0.9984892,-0.38912448,-0.60070306,0.16420619,0.5583108,0.5528851,0.2546989,-0.86803263,-0.12878078,0.62317085,-0.5090036,-0.43962026,0.22876602,-0.19764991,0.20821409,0.14330375,0.90029377,0.45258456,1,0.10874992,-0.4631725,0.17051221,-0.32576314,-0.82266945,-0.1804774,0.11716423,-0.1801689,0.25936458,-0.074376024,0.0811048,0.51148707,0.17821369,0.6331294,-0.40869924,0.29472035,-0.1612997,-0.10222166,0.5619637,-0.41897127,0.23995009,-0.3403186,0.38808027,-0.24589406,-0.8761293,0.19101827,0.120744996,0.4229038,-0.47651732,-0.39773732,-0.32233268,-0.54477423,-0.17431647,-0.13914023,0.53782207,0.49683562,0.32495007,0.265152,0.11647719,0.54455745,0.9999584,0.007120467,-0.97390264,0.49958324,0.9996466,-0.30523962,-0.6747866,-0.9988414,-0.3559693,0.40966856,0.47923228,0.049026664,-0.37421668,0.3237642,0.10728424,-0.052558992,0.51271075,0.1040805,0.025915835,-0.04908612,0.2450174,0.08562402,-0.99998426,-0.99958974,-0.99006677,0.05934462,0.47537714,-0.3127364,-0.43304598,-0.4781683,-0.7888053,0.26736605,-0.15508245,-0.17687032,-0.74616563,-0.066157304,0.48764625,0.043423504,0.5860634,-0.4834545,-0.13016634,-0.9749945,-0.9999577,-0.54581976,-0.3769291,0.116955265,0.2791428,0.26526248,-0.9896961,0.12965186,0.077811226,0.35096788,-0.45647034,-0.23855807,0.41042328,0.9146825,-0.120399125,0.8846479,-0.15809518,0.36350325,-0.31724447,-0.687418,-0.30655077,-0.3237446,-0.57665163,-0.43558338,0.7683909,-0.13031687,-0.5987076,-0.13378929,-0.22677927,-0.6931106,0.28491515,0.64264876,-0.3591481,-0.07209582,0.5887702,-0.6270312,-0.41820872,-0.37158278,-0.45077693,-0.433785,0.40366748,0.9999633,0.33049494,0.57102334,0.20156236,0.5624812,-0.08366511,-0.14390406,0.21235842,-0.17059481,-0.11110395,0.49504492,0.6502983,-0.021092935],
    [214,1,"CCOC1Oc2ccc(OS(C)(=O)=O)cc2C1(C)C",0.3576202,0.2655135,0.16666393,0.28087422,0.21635191,0.15131354,-0.37669325,-0.40196034,-0.17611828,0.3580087,0.25801045,0.54610735,-0.018254071,0.59846,0.18091452,-0.65409404,-0.24897295,0.092018016,0.28777808,-0.2160555,0.5351336,-0.120778196,0.39361423,0.4837198,0.7858521,-0.16950844,-0.35966492,0.56822217,-0.15837537,0.15191211,-0.39752305,-0.12442708,-0.52216804,-0.58629596,0.2615563,0.23600967,0.0594513,0.093160495,0.9965493,-0.37996763,-0.88376254,0.16206703,0.059054974,0.5156528,0.31670168,-0.8325413,-0.09648091,0.57687545,0.862886,0.387192,0.7866346,0.38697654,-0.026576173,-0.22749999,-0.28936306,0.48279938,-0.12085021,-0.09592906,-0.018679412,0.036466476,0.06405879,0.4461831,0.50099295,0.20361455,-0.019159328,0.724654,-0.027009333,0.03050041,0.35500386,-0.122774675,-0.25694796,-0.99671096,0.5417497,0.093693934,0.099995464,0.12385889,-0.19405638,-0.07627629,-0.2988205,-0.9996095,0.34710407,-0.36001092,-0.8740606,-0.5571769,0.3603774,-0.06671997,-0.5402481,-0.119505316,0.17283554,0.06351999,-0.73549044,-0.15560786,-0.32639235,-0.24752982,0.99876475,-0.26951456,0.24960728,-0.46545798,-0.4547698,-0.5421143,-0.3496217,0.2282927,-0.13449028,0.08334457,-0.9299488,-0.80108315,-0.17828853,0.2750498,0.9571295,-0.057377137,0.50824255,-0.104636356,0.25276577,-0.37007782,-0.17342679,-0.13801225,-0.7706197,0.005257129,0.99768096,0.01347525,-0.51915574,-0.44987258,-0.106926456,0.040775526,0.39819327,0.052681077,0.24112064,-0.31172976,-0.21803328,0.99500775,-0.3748234,0.13697997,0.61382645,0.13496925,0.61842483,-0.9732437,-0.16929582,-0.039542623,-0.054086167,-0.19267315,-0.9998515,-0.34513554,0.72912747,-0.30248207,0.19941999,-0.04889174,-0.14517085,-0.3542867,-0.10080044,0.14144497,0.80205315,-0.28985965,-0.099601276,-0.49534485,0.54899955,0.13743609,-0.38818863,0.9088504,-0.7612989,-0.9086098,-0.949817,-0.25424948,0.21173026,0.57340574,-0.31659716,0.44208497,-0.07055166,0.65447974,-0.34176752,-0.4050277,-0.3208273,0.08405848,0.6658661,-0.18470173,-0.27091834,-0.9326511,-0.46819523,-0.5528408,-0.661321,-0.18958348,0.562984,-0.99197125,0.63896674,-0.49399954,0.26463023,0.36069298,0.37867668,-0.4552853,0.44446823,-0.6646819,0.31545994,0.07201076,-0.17882603,0.32900798,-0.17553604,0.4849088,-0.19762778,-0.88471717,-0.05388891,-0.012242336,-0.24006957,0.24715737,0.60627985,0.2645626,0.4234575,-0.19307615,0.51060736,-0.571203,0.11391093,-0.99971104,-0.09015716,-0.43024376,0.000893873,-0.40695834,0.6776158,-0.19870378,-0.2157993,-0.3857936,0.24408142,-0.58819276,0.15341106,-0.6214206,0.32412216,0.2914082,-0.9725838,-0.6090341,0.090591036,0.3020911,-0.5101649,0.30055487,0.20605242,-0.57454413,-0.017045846,-0.36392185,-0.3664048,-0.19699869,0.003168528,-0.3765611,0.17658278,-0.18710448,0.8851846,-0.33176166,0.35744715,0.07475079,0.27040586,0.33669528,-0.28396234,-0.117123574,0.3965045,0.694729,0.25400314,-0.9786589,-0.27754796,0.3270436,0.048562177,-0.15105559,0.15415093,-0.100311376,-0.02462738,0.092603244,-0.36604777,-0.047037423,0.3197792,0.36316738,0.1354807,-0.59004176,0.02752693,0.5938177,0.85729575,-0.07435225,0.33011034,0.99081945,0.530249,-0.4497171,-0.6385882,-0.7538396,0.20305562,0.30027848,-0.13965195,-0.5788277,0.20748064,0.9988017,0.39211854,-0.5684862,-0.8813828,-0.18139513,0.25066853,0.40507734,0.81317693,0.6667263,-0.31820288,0.9911116,-0.0842458,0.8228384,0.13474126,0.15320028,0.999973,-0.8154256,-0.15763304,-0.25413486,-0.22520271,-0.20410907,0.027571214,-0.29601267,-0.44608977,-0.18935816,0.017480027,-0.45793697,0.07566773,0.28360438,0.06040285,-0.32512522,-0.53714186,-0.7662641,-0.811419,0.26545358,0.58317345,0.4146432,-0.9997833,0.1043907,-0.066666916,-0.5165445,0.34249496,-0.30579636,0.7833523,0.0596526,-0.7237714,-0.41922075,0.41003597,0.46264875,0.51711595,-0.7182884,0.49325037,0.26986822,0.2966217,-0.78616935,-0.23273456,-0.06608007,-0.11042542,0.081105806,0.20961605,-0.32293105,-0.23104714,0.669693,0.68318987,0.07309045,-0.10719759,-0.12690918,0.06225206,-0.31855944,-0.962157,0.5682777,0.3625703,0.25264707,-0.61249876,-0.35131258,0.62505376,0.99987924,0.6953783,0.35534707,-0.03429747,0.1904765,0.5328561,0.12660621,-0.34091222,0.10483748,0.19592,-0.03010167,-0.2565985,-0.27485156,0.20824036,-0.09037435,0.45214564,0.062078424,-0.3813221,0.99819154,0.08290284,-0.392166,-0.368171,-0.063693225,-0.625879,0.0868375,-0.6494927,-0.5239748,0.07828053,-0.3037977,-0.0612775,0.23155424,-0.017510314,-0.37088907,-0.017011782,-0.06466972,-0.3365435,0.22679481,0.008122124,-0.41477495,0.4750414,0.455639,0.5474766,0.14711884,0.6776544,-0.09566831,0.8417155,0.099224076,-0.25498927,-0.093588024,-0.3892723,-0.2593633,0.48284104,0.109700546,-0.820288,-0.2829974,0.46059045,-0.0757903,0.2178976,-0.13547069,0.9999991,-0.34147748,-0.9765726,0.09253366,0.99974173,-0.45818508,-0.6983431,-0.9997487,0.6752922,-0.7956772,0.43547854,0.5991572,-0.056022692,0.34946993,-0.31669486,0.6215967,-0.44999334,0.63330567,0.5000439,-0.15357362,-0.46487242,-0.7051921,-0.99998474,0.9953891,-0.92274535,-0.43267018,-0.4490304,-0.059120376,0.09908002,-0.06468639,-0.72214854,-0.39640737,-0.39628294,0.33261254,-0.60675734,-0.49016243,-0.14562994,-0.256713,0.5114182,0.007044809,0.13924259,-0.48788226,-0.9999091,-0.4189408,0.13097306,0.62996906,-0.20126599,0.09021397,-0.2628903,0.74618906,0.48015088,0.09842582,-0.2697987,-0.6921979,-0.20291667,0.93633527,-0.5872872,0.5182774,-0.5704484,-0.17828652,0.24826795,0.40856966,0.10916601,-0.3139835,-0.717574,0.45682004,-0.59964526,0.51023734,-0.052286457,0.77781385,0.4176793,0.24958454,0.20511377,0.23483266,-0.64250857,-0.2558818,-0.6037727,0.9123681,0.41101274,0.682986,-0.34902814,0.6644505,-0.023734871,0.9999424,0.288033,0.5185332,-0.583718,0.31525788,-0.06159725,-0.08316514,-0.9782234,-0.27288133,0.41042668,-0.083907515,0.6031234,-0.000807535],
    [215,1,"CN(C)C(=S)S",-0.8436291,0.3954822,-0.64501226,0.11935356,-0.5429565,0.047023013,-0.6967114,-0.5966303,-0.85189456,-0.034474876,-0.728946,-0.64749634,-0.34632775,-0.51091045,0.5295858,0.36629406,-0.6738643,0.26763722,0.2598724,0.5174372,0.056252748,-0.91643935,-0.2532422,-0.19736108,0.22113934,0.25864288,-0.060461074,-0.33902094,-0.2669041,0.54967123,-0.031643424,0.51770586,0.49862674,-0.4374492,0.06946576,0.1572778,-0.5882233,0.8661857,-0.96127933,-0.9190474,-0.9903425,-0.8522028,0.3621329,-0.22048008,0.47517982,-0.9944398,-0.058224846,0.0650959,0.97391057,-0.5696792,0.14705807,-0.6996434,-0.45326152,0.010847112,-0.92411697,0.13264392,-0.2216183,0.96230614,-0.5512252,-0.14586769,0.39810345,-0.79640985,0.48743665,-0.19243129,0.601284,0.5110791,-0.13637348,-0.4008373,0.015560225,-0.050236706,0.66284704,-0.9963929,-0.07720028,0.790744,-0.23092987,-0.6377114,0.32052743,-0.7092993,0.7090497,-0.9996016,-0.5231445,0.03103009,-0.31900707,-0.481805,0.24884462,0.95297694,0.64788675,-0.5710109,-0.08367879,-0.4797947,0.64093006,0.017403468,0.4043192,-0.40762696,0.7453545,-0.22401278,-0.8530216,-0.027020952,0.3920209,-0.73291326,0.003622789,0.121518835,0.07493684,-0.88284284,0.9897424,0.643339,0.5668355,-0.22561933,-0.65722156,0.14089349,0.003075664,-0.3514474,-0.037728295,-0.7517695,0.415236,0.49979067,0.20616147,-0.07979325,0.9978333,-0.5877731,-0.046403643,-0.38330454,-0.057005323,0.19605468,-0.5295575,-0.280826,-0.0731031,0.36295342,0.12902142,0.9921354,-0.13942213,-0.32791737,0.30206507,-0.057342064,-0.445862,-0.2491052,0.024063986,-0.20782995,-0.14292589,-0.25186804,0.9994615,0.51446307,0.98310775,0.49344644,-0.4446088,0.3566046,0.19929884,-0.36390638,0.9961054,-0.67205334,-0.21809271,-0.23601231,-0.18631509,0.05030796,-0.367093,-0.53471315,0.31525442,0.9991323,0.14913931,-0.72556573,-0.9858466,0.32890186,0.08071143,0.39077884,0.15558557,-0.6812355,0.55505043,0.7594201,0.26067296,-0.052138332,-0.7359736,-0.39206108,0.23862323,0.5389217,-0.13743229,-0.9543165,-0.75145215,-0.31860763,-0.32592472,-0.14868046,-0.3804748,0.048953693,-0.20655662,0.44428372,-0.891254,-0.23324947,0.3391413,0.74430615,-0.5634819,0.10741337,0.64371854,0.26901844,-0.36252886,0.5831768,0.23452212,-0.69761044,0.1767639,-0.6578016,-0.30390164,-0.55527234,-0.67509305,0.08691455,-0.687122,-0.44074312,-0.5253917,0.6547186,-0.14610158,0.12549514,-0.27714455,0.85479546,-0.17563134,-0.52677,-0.34294936,0.006828909,0.6375475,0.6783597,-0.23341241,-0.01904704,-0.23933221,0.4286017,-0.5926437,-0.66049576,-0.36671266,0.006245905,0.9803232,0.0973265,0.13448039,-0.52574885,0.066622905,-0.11992965,-0.15589869,-0.30454665,0.41743484,0.012369758,0.42326486,-0.5901953,-0.0812544,0.25876546,0.475933,-0.1020612,0.4380241,-0.014618516,-0.30002093,-0.4077019,-0.09970026,-0.43260786,0.47964036,-0.12875108,-0.3428729,-0.41634947,0.87794536,-0.99913126,-0.40445113,-0.46189442,-0.10062786,0.35788706,-0.22731297,-0.18114376,0.3472337,-0.03821932,-0.62277365,0.10063457,-0.29032707,0.004358204,-0.38816574,-0.662224,-0.4355702,0.3655137,-0.40435874,0.32407647,0.1752221,-0.0441766,0.03344087,0.5099283,0.3537269,-0.1265472,0.08361542,-0.7828375,-0.5958481,0.43013215,-0.31389126,0.9979604,0.19229926,0.41997764,-0.30659896,-0.00464822,-0.7359702,-0.3270332,0.6013444,-0.3693401,0.40477043,0.9989618,0.25839135,0.74738824,0.6766069,-0.370858,-0.99872243,-0.18236296,0.01677249,-0.050922386,-0.024775691,0.16856116,0.6056509,0.15279783,0.107583396,0.09833503,0.9997471,0.50838137,-0.28502536,-0.14430146,-0.066860594,0.19746746,-0.4836654,-0.27392307,0.83513397,-0.16672774,0.24815996,0.25334662,-0.96095985,-0.29154715,-0.66316104,0.3467971,-0.28116205,0.28853714,-0.30067006,-0.25933117,-0.046967104,-0.8217564,-0.3282319,0.26416722,0.19781739,0.1044333,0.84586596,0.38669568,-0.29547042,-0.278612,-0.5829628,-0.7679609,-0.80875427,-0.27822483,0.22440122,-0.4228748,-0.20670108,0.2308007,0.34374523,0.40126228,0.5609346,0.09559014,0.37919718,0.98310906,-0.9845126,-0.2955315,0.083164975,0.35017765,0.6937119,-0.5731897,-0.12364039,0.71628773,-0.51641244,0.096663155,-0.18910766,-0.010242554,-0.65854347,-0.48245534,-0.15507303,-0.25469342,0.103333086,-0.50499845,-0.33638093,0.5477864,0.22555402,0.05942589,-0.4318248,0.94663274,0.18172812,1,0.45649064,-0.16195618,0.4729449,-0.6860608,-0.9487904,0.40327898,0.29614305,0.26240876,0.01156664,0.3999396,-0.41850322,0.09240342,0.23836547,0.06634505,-0.5130234,0.01437353,-0.44632363,0.22986321,-0.74223775,-0.3481094,0.5586798,0.66732544,0.78383213,0.30514285,-0.929643,-0.2393325,0.11757534,0.025645556,0.30170348,-0.26940545,-0.7141799,0.070896976,0.010822245,-0.65811807,0.6655009,0.6215952,0.47461984,0.42432997,0.047246203,0.35451302,0.9998829,0.11142008,-0.4086509,0.011014313,0.98457,0.17140399,0.2171055,-0.99745786,-0.12741205,0.6787779,0.588515,-0.58233577,-0.70120573,0.33376572,-0.20157431,0.9128656,-0.5370494,-0.40322897,-0.003180007,-0.28904378,0.18031664,0.5207361,-0.99975,-0.99999976,-0.9969229,0.10375172,0.007370184,-0.1119471,0.35822248,-0.24381806,-0.8497196,0.7841893,0.8839676,-0.29580042,-0.25512835,-0.25613594,0.27268794,-0.26840946,-0.5276967,0.20740281,-0.28498393,-0.9957328,-0.99956864,0.08918956,0.43461883,0.41072375,0.40594757,0.067208394,-0.9640896,-0.7410596,0.34382463,0.51659733,0.50188994,-0.32273212,0.4598195,-0.9326216,0.013540282,0.94089735,0.6696953,-0.62457937,-0.13158743,-0.6855875,-0.5442382,0.08643095,-0.2849766,0.7166508,-0.9795809,0.002757588,0.6807325,-0.3192478,-0.39629173,0.4954415,0.29935214,0.27784455,0.8602162,0.23440897,0.042635653,-0.99469125,-0.24048623,0.43335643,0.24378197,-0.3225598,0.33867815,0.9993837,-0.20085944,0.58266103,0.48930213,0.053674396,-0.29953796,0.5057138,0.9669065,-0.015251368,0.001456707,-0.15130171,0.65667444,0.14118996],
    [216,1,"CN1C(=O)N(c2ccccc2Br)Cc2c[nH]c(=Nc3ccc4c(c3)OCC(CO)O4)nc21",-0.3438399,-0.4244571,0.30665186,-0.1062335,-0.7924406,-0.21279892,-0.5064087,-0.365113,-0.5176498,-0.19650124,0.1695805,0.14794336,0.3551407,-0.23696738,0.3058416,0.64728385,0.40990922,0.05369771,0.42888457,0.5305552,0.6909366,0.29200906,-0.18201129,0.71515155,-0.19327855,0.60210997,0.059220545,0.47041997,0.165108,0.687002,0.4581227,-0.34017453,-0.18992974,-0.5901929,0.118495,-0.20940588,0.51143265,0.6703401,0.99962485,-0.14881085,0.7045107,0.38115788,0.88469666,0.6331503,0.54116535,0.9472938,0.52591103,0.5761248,-0.41467255,-0.10103458,-0.4761371,-0.46958762,0.06815454,-0.67469984,0.792662,0.393575,-0.09502563,-0.95077044,-0.087082796,0.26243556,-0.6520113,-0.19414063,-0.35665298,0.25773382,-0.26075038,-0.080677204,0.5420621,-0.024627917,-0.12563881,-0.109707855,-0.9978784,-0.94388646,0.45812073,-0.63990766,-0.6604795,-0.05808927,-0.19610937,0.37767926,0.72208345,-0.9985789,-0.3142728,-0.35958388,-0.93240064,-0.049566712,-0.23882827,-0.7126732,0.107100725,0.29384112,0.16832007,0.28510487,-0.5095079,0.002411504,-0.27685627,0.005905246,0.9997138,-0.066442214,-0.049626563,0.596741,-0.13817647,-0.02959825,0.010731961,0.4537018,-0.3484927,0.9790775,-0.9998579,-0.7519734,0.4375167,-0.65147895,-0.9999544,-0.01176561,-0.689333,-0.3836845,-0.17692858,0.5388312,-0.16390994,0.4842954,0.27989602,0.42768896,0.39774796,-0.3689007,0.6294492,-0.61510295,0.79357105,-0.5626773,0.28951913,-0.41574553,-0.20331818,-0.31645018,0.18548201,0.99706316,-0.09016657,0.21260792,-0.51269567,-0.13709396,-0.3449112,-0.97613966,-0.30009627,0.38740188,0.2407488,-0.73437864,-0.99999976,0.5259048,-0.58559686,-0.45615262,-0.2951371,0.08123282,0.104880325,0.4343322,-0.9995592,0.59959155,-0.1700395,0.30178624,0.032272615,0.62678295,-0.7932121,-0.59955245,-0.48590767,-0.9907525,-0.003222983,-0.08111051,0.63572574,-0.7572751,0.51120824,0.30056745,-0.06397797,-0.7339739,0.049540874,-0.08573144,-0.40499562,0.52386105,-0.03526228,-0.25943637,0.30572158,0.4022714,-0.08966092,0.29332694,-0.2638994,0.005038048,-0.020515675,-0.8539309,0.6656455,-0.9492057,0.08912605,-0.5282062,0.9001545,-0.06581083,-0.30929115,0.47400007,0.4710344,0.43804887,0.5448342,0.028369881,-0.37571743,0.025882367,0.30702084,-0.20224728,0.4984333,-0.4567138,0.4496713,-0.5650558,0.17451273,-0.0996703,-0.52117765,-0.64755243,0.08723992,0.83928996,0.17146274,0.104105175,0.30681306,-0.999843,0.24545349,-0.22845103,-0.1756386,0.3874508,0.76602507,0.21090728,0.0799671,0.17963944,0.0442822,0.31053582,0.7784646,0.6451614,-0.16539575,-0.025624158,0.96707374,-0.67446226,0.19227953,0.16217032,-0.23518878,0.7000836,-0.27764773,-0.44028834,-0.27960446,-0.6223982,0.050813317,-0.61360914,0.59858716,-0.67102754,0.5402874,0.3059262,-0.96152043,0.30547708,-0.45948908,-0.06686185,0.39064306,-0.18642987,0.30444345,0.6715069,-0.27255458,0.5328819,0.7449011,0.6632093,0.44358394,0.03524621,-0.049582817,-0.10498288,-0.12413202,-0.3465708,-0.18997137,-0.048812993,0.23147637,0.09153226,-0.42502967,-0.010006651,-0.49652532,0.5030743,-0.15244387,0.75418943,0.41478696,-0.2378313,-0.34302777,0.9998769,0.03216332,0.55399716,0.7616182,0.001622381,0.86848503,0.33861893,-0.744899,0.11035474,0.4130413,0.8037518,0.4863131,0.30679274,0.3397322,-0.5923645,-0.26604933,0.055700734,-0.98383075,0.44086912,0.33433738,-0.8229466,0.27587712,-0.29639262,-0.16955715,0.19375284,0.99999994,-0.92358893,0.737922,0.042066146,0.48758677,-0.18359138,0.010725622,-0.3655697,-0.093320414,0.6017801,-0.9995812,0.72628766,0.5422555,0.09749573,0.17967929,-0.16107869,-0.001800811,-0.49029872,0.08312751,-0.54781425,-0.5018177,0.59311867,0.9651503,0.40925363,-0.031044822,-0.3813919,-0.40755764,-0.4391655,-0.27954662,0.8369801,-0.74621516,0.27666712,-0.66524726,0.14570622,0.41577622,0.05161372,0.12596224,0.6459933,-0.06667206,-0.21074282,-0.26472247,-0.10889242,0.25925142,0.64153606,-0.023669679,0.5582547,-0.38810468,-0.46893224,-0.03684544,0.7515606,0.0037171,-0.83386976,0.4147313,-0.9902623,0.3109594,-0.021504095,0.41498062,0.036948524,-0.2632969,0.016828468,-0.13706155,0.99923813,-0.6563897,-0.36081493,-0.025037615,-0.18666258,-0.3583074,-0.2854519,-0.79737264,-0.5793766,-0.43795556,0.18422653,0.50332516,0.74143773,-0.48268664,-0.4063975,0.36725608,-0.9633051,-0.6874297,-1,0.1816972,0.14077027,-0.41378793,0.61580694,0.5147184,-0.5775284,0.023191195,0.32198456,-0.18737137,-0.36511925,-0.4581667,0.038822066,-0.62552893,-0.4817731,0.16428243,0.38208246,0.4654419,-0.33933356,-0.09219361,0.39606282,0.17160957,0.26323903,0.10607508,-0.30953455,0.9869119,0.27500942,-0.66727364,0.40334392,0.23579864,-0.20154782,-0.12450861,-0.51002586,0.7453108,0.587513,-0.42314798,-0.19662519,0.21529227,-0.28108522,-0.18819684,0.16255894,0.7057479,-0.29131287,-0.96147066,0.009291252,0.99940425,-0.45148826,0.36535165,-0.9511563,0.12588099,-0.88767624,0.30365518,0.25062734,0.29374567,-0.27716255,0.21607465,0.043812677,0.5090156,0.3726026,-0.4667711,0.24195395,-0.19321683,0.06314538,-0.9994659,1,0.9184389,-0.36528012,-0.1925053,-0.25265867,-0.5781554,0.5379718,-0.15492605,0.29613757,0.17472935,-0.22084509,-0.5003878,0.4546272,-0.1655116,0.46869606,0.7047346,-0.13747397,-0.060853053,0.99169457,-0.9927288,0.3948727,-0.3824064,-0.19823249,-0.44259396,-0.38306987,0.35193852,0.46422777,-0.41864517,0.49732438,-0.7715737,-0.5147186,0.06608714,0.9894742,0.70511174,0.8139985,-0.2203933,0.4817357,0.08179671,-0.6069538,-0.44278058,-0.44685856,-0.25097936,0.36903566,-0.97176933,-0.5294953,0.34707955,0.27528462,0.18631966,0.007242818,-0.09920246,0.15167004,0.37692863,0.6920629,0.019234607,0.999704,-0.048014086,0.0908394,-0.22061317,-0.2396439,-0.16292651,0.9999288,0.016762422,-0.1116804,-0.012380922,-0.11817087,-0.18004546,0.43305364,-0.99946016,0.1350176,0.33740214,-0.1553296,-0.16094618,-0.058393296],
    [217,0,"N#CC(CCc1ccc(Cl)cc1)(Cn1cncn1)c1ccccc1",-0.35470518,0.055688187,0.2980979,-0.17129496,0.4260875,-0.7434208,-0.4360753,0.15729912,0.5518515,-0.14336084,-0.31721982,-0.33159092,-0.002687005,-0.8687364,0.18156974,0.08192263,0.55708396,-0.17025514,-0.108069256,0.18655346,0.4874378,-0.32037523,-0.36266616,-0.48011407,-0.22979046,0.28293636,0.42872697,0.36693984,0.61485577,-0.522873,0.46218592,-0.72678095,0.7362266,0.46833014,-0.2785464,-0.31182688,0.49893814,-0.09196168,0.99796,-0.74420726,-0.53441066,0.25904822,0.3565459,-0.24963689,0.090436004,-0.22030735,0.097373515,-0.22237796,0.9171281,0.21045817,0.27219722,-0.007994775,0.37091318,-0.34052506,-0.83470637,0.33397996,0.055394612,-0.24519663,-0.06420957,0.23616129,-0.10537211,0.25690174,0.37586588,0.15902501,-0.024709204,0.054985754,0.30184692,0.8425097,-0.44903776,0.47821984,-0.6413141,-0.8045093,-0.09188375,0.23431364,0.61132395,-0.48174068,0.79905,-0.60633266,0.16821347,-0.9990263,0.31670466,-0.49862581,-0.9075113,0.086469725,-0.68652934,-0.9100954,0.4535247,-0.41408613,-0.61504865,0.01595527,0.0812064,-0.34467715,-0.1432268,-0.3749411,0.9906621,0.2511057,0.48870116,0.063701294,0.47184777,0.100749984,0.47494102,-0.5535507,-0.20531464,0.9835598,-0.99390775,-0.8127421,-0.5972345,0.14222826,0.9817077,-0.50590163,0.15747082,0.34354514,-0.07645781,0.6992459,-0.6529155,0.3765588,-0.16916458,-0.10984322,0.9814059,0.12307462,0.3802314,-0.4944024,0.35703608,0.3432131,-0.2725022,-0.65614736,-0.56095964,0.25114664,0.36277822,0.999824,0.28002903,0.46646395,0.37886977,0.05377575,0.503396,-0.9928181,0.1299215,0.04200083,-0.054767802,-0.41339386,-0.9999926,-0.22095053,0.8304197,-0.3376458,0.8855526,0.4908649,0.02527556,0.49768665,-0.9151558,-0.21531346,0.13104533,-0.720338,0.5191455,0.5723872,-0.009358102,0.028228993,0.27545506,0.03956079,-0.072405815,-0.9257957,-0.6889718,0.39332056,-0.3836543,-0.6017819,0.4296527,0.20458154,0.06707298,-0.08611176,-0.12192081,-0.19792032,0.29369497,0.6165802,-0.6453892,-0.021604443,-0.1729963,-0.55419445,-0.51376635,0.50864285,-0.5265722,0.205163,0.03927841,-0.75232357,0.17812361,0.41778314,0.35410875,0.69006115,0.036649864,0.052491687,-0.48492566,-0.19963527,-0.57735586,-0.6651501,0.37574843,0.18961015,-0.09385836,0.11468281,0.12535633,-0.2861961,0.19630976,0.26587835,-0.218629,-0.31349415,0.013575486,0.44531992,-0.43857276,0.18004899,-0.07220824,-0.3522019,-0.56765705,-0.99980146,0.57355607,0.65359235,0.5610821,0.09421844,-0.28109244,0.3516982,-0.55442435,0.5425273,0.6525059,0.14654621,-0.31615433,-0.29544985,0.46530113,-0.420553,-0.9540528,0.17926663,-0.13866045,0.042643994,0.23780605,0.11150767,0.20741773,-0.24328926,0.72519594,0.70081204,0.21618949,-0.82558125,0.24914376,-0.79829997,0.29824182,-0.54250795,0.85540795,-0.06633953,0.5031165,0.2781891,0.45666793,-0.22840883,-0.5177289,0.12555552,0.37158212,0.71224976,-0.13139547,-0.733274,0.43060467,0.3889748,0.10042122,-0.41807958,0.16852094,0.20700903,0.608053,-0.24732082,-0.5492122,-0.23760797,-0.57631505,-0.008772873,0.3669984,0.22477502,-0.004943566,-0.19884996,0.7861125,-0.1705858,-0.64227253,0.990904,-0.72366995,0.46001497,0.22623926,0.91866225,0.72097087,-0.8255487,0.316205,0.16024001,0.9189796,0.9965379,-0.25102225,0.39780912,0.6073022,0.82498443,0.44269407,0.880079,0.7855742,-0.3503341,0.4403415,0.91155654,-0.20835117,-0.21265551,-0.31909588,-0.6624608,0.9999989,-0.9900035,0.3234647,0.19830827,0.10882855,-0.23688117,-0.4262084,0.42516407,0.8822024,-0.25301993,-0.96686286,-0.20174511,0.8263011,0.5432464,0.4263454,-0.002219473,0.06620018,0.22938873,0.39422876,0.14470828,0.3364837,-0.02044471,-0.9999286,-0.35879114,-0.7994888,0.3089181,-0.73308206,-0.14504965,-0.3823116,-0.47837368,0.6363111,-0.7458491,0.086873114,0.5615274,-0.2933564,-0.1339842,-0.48083976,0.26453736,-0.3245985,0.7194067,-0.21953638,0.55786717,-0.3375029,0.3548066,0.008558881,-0.8073895,0.58565456,0.536551,0.34506106,-0.5127976,-0.930692,0.5520569,-0.7113431,-0.77942497,-0.93654436,-0.35561234,0.11466089,0.102322504,-0.6612646,0.69907254,-0.07352445,0.9995377,-0.26911047,0.25568813,-0.35934803,-0.20175101,-0.078898795,0.4688589,-0.6541645,-0.31353834,-0.022333413,-0.3375262,0.3566055,0.53606266,0.276283,-0.17603555,0.08979289,-0.51584303,-0.026025165,-0.9910249,0.7411862,-0.18028447,0.50313956,0.3192676,-0.038212698,0.31914824,0.38171163,-0.8196252,0.22217034,-0.45307288,0.05613698,0.21738793,-0.72804964,0.24264993,0.104331054,0.29789102,-0.23060763,0.6156925,-0.26222008,-0.5038487,-0.47462755,-0.28136846,-0.24725075,-0.31937563,0.18490438,0.14282395,0.114262275,0.41887966,-0.34477645,-0.14226732,-0.7690092,0.56099594,0.11607386,0.4359718,0.71018195,0.64742637,-0.05215329,-0.06261329,-0.26499343,-0.30826187,0.99999976,-0.06619642,-0.97239244,-0.6862781,0.99469507,-0.7482801,0.41112828,-0.9999334,0.43184966,-0.58522016,-0.6831986,-0.20283097,-0.5381534,0.24953566,-0.3478561,-0.3188465,-0.22110376,0.114588484,-0.43393612,-0.9138895,-0.3763645,-0.695254,-0.9999488,0.99999964,-0.19842051,-0.6289568,0.29361793,-0.09377823,0.5932383,0.12392871,-0.07029514,-0.10317853,-0.3156432,0.10674934,-0.21094483,-0.38254073,-0.51362455,0.11547813,-0.62312,-0.15577242,-0.3651426,0.7324115,-0.9997241,0.71725875,-0.6396265,-0.23818274,-0.06129722,0.14785755,-0.8595498,-0.2293161,-0.105168246,-0.30073345,-0.19641973,-0.16110513,0.4446785,0.96781266,-0.27886993,0.1794358,0.19360812,0.083141856,0.1937587,0.063728444,-0.42325458,-0.325201,0.36460546,-0.16391322,-0.8339705,0.48034817,0.66050774,-0.4556647,0.32863727,0.21840075,0.2763982,0.55556494,-0.078095876,0.38778988,0.48990765,0.99692684,0.090636715,-0.4262669,0.16931383,-0.093322106,0.2880151,0.99941784,0.77555394,-0.6231872,0.08808556,-0.055422984,0.46114323,0.33254838,-0.9956384,-0.4684773,0.5856509,0.3132942,-0.15827788,0.54923296],
    [218,1,"CC(=O)N1CCN(c2ccc(OCC3COC(Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1",-0.15883294,-0.18924144,0.5888525,-0.13663082,-0.001810762,-0.36256948,-0.64109737,-0.16955926,-0.11570637,0.35046807,0.3326873,-0.21578056,-0.20602815,-0.36361098,0.14503992,0.17298387,0.18150578,-0.864575,0.43518534,0.61344624,-0.4120939,0.5981863,-0.2162816,-0.030627742,0.0670544,0.46616182,-0.5976908,0.7951627,-0.18672279,-0.6281595,-0.19602025,-0.6884384,0.38584694,-0.2921142,-0.14765635,0.11661625,-0.73161834,0.6568981,0.9997767,-0.52376354,0.49907282,0.5521266,0.44099748,-0.4971006,-0.3446056,0.9909847,-0.81997156,-0.054890133,0.7443895,-0.678209,0.08383719,-0.23024218,-0.25333738,-0.41341037,0.7587887,-0.088029146,-0.10912679,-0.98183244,-0.23354745,0.3706091,-0.68249875,-0.35690293,-0.037524514,0.39960414,0.20162703,0.40475076,0.130523,0.1953813,-0.27730933,-0.09136551,-0.98975915,-0.84198046,0.3051162,0.05595783,0.41487613,0.47894424,0.08274249,0.34601745,-0.13602382,-0.99490243,0.82839954,-0.64994305,-0.9668602,-0.109420665,-0.24228962,-0.9035112,-0.28453195,0.06996326,-0.54969585,0.47841752,-0.024412515,0.41397583,-0.51267177,-0.52864,0.99855494,-0.5084777,-0.04784334,-0.5509814,-0.008294891,-0.43682942,0.11853451,-0.1475537,-0.42345032,0.9956423,-0.999895,-0.7568835,-0.042329296,-0.24536297,0.95114964,-0.25662017,0.73536414,-0.2683782,0.23823649,-0.14156587,0.36823386,-0.10919831,-0.14751805,0.4410415,-0.67155015,0.5798911,-0.05601389,0.5510911,0.36565784,-0.75411874,0.15494841,-0.43894863,0.5540904,0.010429719,0.57237816,0.9988096,-0.09766046,0.11727773,0.014525203,0.75905544,0.7432968,-0.9849075,0.11105845,-0.29442698,0.5537381,-0.45913842,-0.9999999,-0.6450699,-0.5146745,0.06685947,0.5035947,0.027789628,-0.17177667,-0.31182677,-0.99994093,0.06923178,-0.04503963,-0.11997779,0.3781541,0.048200786,-0.5996982,0.41265252,-0.25719622,-0.99808204,0.17602393,-0.9689437,0.9447232,-0.035450615,-0.18883596,-0.87784827,-0.3394553,0.26802078,-0.12728275,0.43964857,-0.04350893,-0.16539383,-0.41627628,0.1444032,0.15958099,0.42993808,0.23526753,-0.6449581,-0.44391143,0.59069616,-0.8620133,-0.62449557,-0.002945588,-0.69515556,0.05911462,-0.117965035,0.95783216,0.62993246,0.21672787,0.49040607,0.33430794,0.8693008,-0.5978272,0.13985388,-0.44035077,0.13028544,0.040983494,-0.37345874,0.27740812,-0.9140635,0.12586622,0.8085581,-0.8944945,-0.44137192,-0.10729763,-0.2363417,0.6387732,-0.013821707,0.44657043,-0.7054398,-0.16096441,-0.9998323,0.55675584,0.112151586,-0.22368047,0.629677,0.29022992,-0.07206014,-0.60634255,0.7547074,0.819674,0.07725155,-0.2274856,0.66530675,0.2276938,0.60169125,-0.9713065,-0.049380127,0.2311647,0.5829897,0.07415981,-0.022730695,-0.5042778,-0.43444735,-0.002899003,0.1799051,-0.05382792,-0.5741369,-0.12418292,-0.002841614,0.54687965,0.098053545,0.89693105,0.6271617,0.052019224,0.4523147,0.3211306,-0.050615937,-0.2737488,0.34503803,0.2727716,0.7487451,0.44033185,0.6824316,-0.4609577,-0.14771731,0.54025877,0.616656,0.15957822,0.10488696,-0.38001797,0.47381625,0.52476406,-0.23663764,0.20105915,-0.13369763,0.08435846,-0.73327214,0.5875933,-0.026593894,0.9595277,0.1947722,0.11138817,0.999672,0.1057425,-0.07660842,-0.42990142,-0.7263072,0.27927396,-0.57371837,-0.4801965,-0.2687661,0.3372563,0.15589163,0.6908858,-0.261664,-0.12594153,-0.65216345,0.35624376,0.96878767,0.51750064,-0.43412086,0.42426276,-0.9719978,-0.2065015,-0.5988581,-0.25450733,0.3343659,1,-0.94799876,0.3945243,0.29402375,0.043563496,0.3055621,-0.079055496,-0.31958705,0.012819043,-0.07207332,-0.9999354,-0.3313799,0.974553,0.1111473,0.33270642,0.85169905,-0.65883327,0.25798744,0.3796748,-0.19257589,0.05985521,-0.3473686,-0.99986047,-0.2521904,0.09461135,-0.71743315,-0.19406745,-0.55572873,0.7347093,-0.5010197,-0.660855,0.47729552,-0.164486,-0.30772412,-0.21080431,-0.15699959,-0.23049589,0.37914866,-0.34277743,0.3899827,-0.20966978,0.58321244,-0.6736708,0.09546053,0.6595737,-0.7927419,-0.04813798,0.08351294,0.39719176,-0.29718485,-0.58081573,0.1271013,0.04973549,-0.9950525,0.77752787,0.10677478,-0.22541766,-0.46505943,-0.10050475,0.41828525,0.2176311,0.99873406,-0.38124296,-0.23429945,-0.7197608,0.010026844,0.6094964,0.39802063,-0.5239522,0.21624464,0.037525687,-0.28703764,0.3655471,0.38321483,0.54191715,0.2273324,-0.38199165,-0.90252876,0.07717764,-1,0.06979499,-0.535198,0.73560387,0.00147103,0.90301347,-0.45679486,0.76725984,0.29298338,-0.32596216,0.2391236,-0.29789546,0.07154604,-0.27767512,-0.9242414,-0.17730516,-0.02321659,0.48448732,-0.26138997,-0.06645828,0.7305203,-0.027578091,-0.38894287,-0.65209407,-0.7589629,0.9829913,0.6252709,-0.65913725,0.5839465,0.6072716,-0.5575577,-0.8823457,-0.54110384,0.16833055,0.43663934,-0.14361072,0.65652955,0.51697063,0.43519145,-0.3123891,0.22953388,0.9999986,0.63821363,-0.92790353,-0.5961205,0.99416083,-0.18711473,0.79424787,-0.9998904,0.8173216,-0.99276674,-0.8301687,-0.46687272,-0.36474812,-0.046531375,-0.039837874,0.20770176,0.048953086,0.47505468,-0.46213323,0.06484698,0.13182549,-0.29381323,-0.9969246,1,0.98713017,-0.7100094,0.44631135,-0.68634456,0.18130688,-0.2135374,0.51155597,0.122354165,0.25733423,-0.34880823,-0.37942845,-0.24449623,0.55856174,0.48008505,0.6258621,-0.28007838,-0.08508302,0.9976734,-0.89646447,0.7260356,-0.72593933,-0.029540602,0.123759046,0.27536204,-0.266614,0.41899997,-0.1537158,-0.566823,-0.20777719,-0.701306,0.27033302,0.902558,-0.23503633,0.7910145,0.18667248,0.52317894,-0.5518108,0.41113266,-0.2247513,-0.19409259,0.17465018,-0.1384577,-0.94427794,0.6304878,-0.08931127,-0.14979833,0.7307277,-0.45651466,0.63327926,-0.43344367,-0.132822,-0.10752774,0.17875738,0.9998635,0.06713984,-0.5456163,0.062140778,-0.39099175,0.5453727,0.9991385,0.40663925,0.74210197,-0.15845694,0.6191103,0.37084913,0.61382043,-0.99892,-0.27352008,0.46153855,0.23582366,-0.25333196,0.37624973],
    [219,1,"C#CCC1=C(C)C(OC(=O)C2C(C=C(C)C)C2(C)C)CC1=O",0.81942135,-0.41066715,-0.15539265,0.37043178,0.48873526,-0.04152543,0.24778497,0.011054697,0.5785727,-0.13985324,-0.07200368,-0.84666014,-0.16457653,0.8103564,0.3278485,-0.9120768,-0.39939496,0.3276525,0.40265134,-0.19247772,0.05936328,0.47147197,0.83542806,-0.65174043,0.18351899,0.05650925,-0.3517058,-0.10191497,0.39798558,0.27950525,-0.23947403,-0.002563292,0.35343045,0.089134015,0.47007948,0.40279147,-0.7701589,0.22628662,0.99933267,0.12891461,-0.7164435,-0.040574353,-0.071723126,-0.66907555,0.09658958,-0.32657272,0.3420222,-0.18232948,0.99415785,0.40728074,0.2625152,0.46772048,-0.1259347,0.04061608,-0.3990438,0.42843035,-0.03459643,-0.61928016,0.5218278,0.1656389,0.42369172,-0.16154775,0.14437863,-0.3195128,0.448847,0.2940218,0.54661226,-0.5836558,-0.057896506,0.004068315,0.08627484,-0.8596541,-0.28337705,0.8076899,0.45181522,-0.19372822,0.6869555,0.5025758,-0.011902988,-0.99981433,-0.15565202,-0.11174616,-0.7951012,0.49797857,-0.053124495,-0.75540715,-0.24801451,-0.5884317,0.65942967,0.6371588,-0.24824129,0.24083003,0.28152364,-0.3426254,0.9971442,0.4046349,0.40849483,-0.23628989,0.18273018,-0.118953556,0.1330004,0.72688824,0.09199588,0.68777287,-0.9968995,0.23630516,-0.40594313,0.71175575,0.9602358,-0.6824451,0.11612368,0.50224805,0.6856908,-0.06720323,0.64457023,0.25010204,0.26817784,-0.20030291,0.9808894,-0.3109671,0.07236527,0.32180315,0.69370395,-0.70660824,-0.43807077,0.14737447,0.11064594,0.34794354,0.41510054,0.999411,-0.11878646,-0.23328689,0.3981503,0.1947107,0.47558403,-0.9947851,-0.2657647,0.57023317,0.13987343,-0.69777554,-0.9999764,0.52424115,0.7347934,0.041907635,0.53438437,-0.46714267,-0.16147678,0.5120772,-0.9606065,0.004265341,0.30782562,-0.85190743,0.66399086,-0.27911246,0.5734899,0.4994256,-0.5951485,-0.19438888,-0.8150566,-0.9161529,-0.6593492,0.6861577,0.646902,0.22377726,0.7793055,-0.5477114,-0.42571798,-0.21997729,0.14235112,-0.15362513,-0.29950857,0.22821224,-0.48664975,-0.5755235,-0.11433754,-0.88271093,0.59853786,0.028134784,0.64269227,0.06520879,0.26748255,-0.88421804,-0.27436063,-0.106327154,0.68781847,-0.6788116,0.2571833,0.5629593,0.23013689,-0.16724527,-0.7754439,-0.3337761,0.32287598,-0.1091572,0.2294843,-0.6295696,0.41222525,-0.90643376,-0.2208155,-0.16600259,0.23995408,-0.5959629,0.5145009,0.577196,-0.010076561,-0.35324234,0.11536231,-0.13351588,0.44944865,-0.9999459,-0.09163811,-0.4120177,0.88487923,-0.73233396,0.5495327,0.5396443,0.70613235,-0.7938465,0.08206774,-0.1997733,0.47090873,-0.6038172,-0.21943256,-0.20454726,-0.9922555,0.8086731,-0.37470782,0.3165979,0.05068472,-0.006900422,0.5607981,0.21418859,0.682165,0.35963753,-0.22683671,0.30522236,0.3975144,0.81878877,-0.02548522,-0.7431622,0.83746463,0.4139973,-0.10540144,0.104172155,-0.7418871,0.009991425,0.12671578,-0.031886272,0.52520406,-0.31098297,0.6171,-0.969864,-0.07373194,0.24742877,0.0953715,0.03600821,0.14902289,-0.14511459,-0.34561464,0.7351235,0.35175726,0.29203293,-0.35698166,-0.26626986,0.1303348,-0.35028717,-0.44894534,-0.23824522,0.9702476,0.2741195,-0.2635165,0.9994228,0.4155201,-0.47365034,-0.07493424,-0.73014975,-0.87567663,-0.7322825,0.22029322,-0.771632,0.1621796,0.99569565,-0.11297911,-0.46354905,0.04483125,-0.6655205,-0.12847596,0.9112389,0.8931748,0.746976,-0.5800589,0.8800263,-0.31820428,0.69791734,-0.0928325,-0.38858664,0.99998915,-0.9782562,-0.03263071,0.017592972,-0.12126446,-0.12600909,-0.21912627,-0.26677933,-0.44565564,-0.84834456,-0.95634824,-0.6569033,0.42358798,-0.63943815,0.17916456,-0.39937624,0.21450368,-0.7608971,0.22476369,-0.6190691,-0.113193855,0.86034703,-0.9997832,0.5272892,-0.57946014,0.36498648,-0.44988853,-0.06709139,0.2629454,0.54638606,-0.6475774,-0.73089993,0.63271284,-0.77667314,-0.008769129,-0.58680964,-0.30259162,0.62692606,-0.5133801,0.42443416,0.06097828,-0.23109853,-0.10140491,0.010360529,0.596358,-0.43266812,0.79867387,-0.033749636,0.51525694,0.07431943,-0.41254634,0.26447713,0.07531722,-0.8227427,-0.8840557,0.60597706,-0.23606923,0.26833963,0.123405285,0.33381176,-0.7119547,0.99980694,0.6901502,-0.19363198,-0.5973859,0.21513672,0.41897136,0.67842627,-0.6724018,0.36996517,0.5800641,0.80105877,0.72334987,-0.39246973,-0.66417074,-0.58223015,-0.23078848,-0.2820247,-0.3183413,0.98075,-0.13044131,0.22017461,0.16268165,-0.35828075,-0.6639584,-0.58592236,-0.38878968,-0.11743913,-0.37701148,-0.07669556,-0.39836735,0.34533134,0.45761737,-0.84014094,-0.23333445,-0.08868758,-0.14130609,-0.75650054,0.07309997,-0.81902766,0.4473735,-0.3809747,0.06746404,0.39094424,0.67210174,0.11586412,0.45261416,0.6401471,0.08895441,0.66562575,-0.2069597,-0.4561193,-0.030144231,-0.46084976,0.2501407,0.20091112,0.7229823,-0.48297963,-0.20234305,0.45495686,0.99999887,0.5075544,-0.90727854,-0.12808079,0.9996699,0.5435146,0.45480347,-0.9999604,0.5230138,-0.8147996,-0.39816687,-0.6070066,-0.3580496,-0.26078266,0.45360956,-0.791748,-0.031572424,0.43462688,0.20973958,-0.4368883,0.17691283,0.32709253,-0.99994725,0.9985576,-0.24660297,-0.28137776,0.17836872,0.48723572,0.38015258,0.07136358,-0.44222954,-0.15761264,0.5585848,0.7018934,0.07875916,0.2775426,-0.6416999,0.054679386,0.30082402,0.40705535,-0.28789318,0.65715957,-0.99970996,-0.1937945,-0.15590616,0.005622502,0.51427484,0.314187,-0.79894507,0.2361132,0.49034637,0.33670393,0.567844,-0.025342412,0.012756631,0.25572595,0.22043395,-0.08385191,0.22950768,0.11346054,0.1587053,0.76933706,0.39562413,0.07946442,0.14163512,-0.34572414,-0.95532274,0.3600698,0.65173817,0.23780584,-0.12706469,0.17356952,0.15132181,-0.5903168,0.24048576,-0.39373446,-0.6944023,0.9947875,0.2687935,0.27992338,-0.5139922,0.49721938,0.077797055,0.99994886,0.33494076,-0.59982145,-0.53535235,-0.08120322,0.12606311,-0.03415528,-0.9992,0.19402878,0.75074965,0.57889396,0.7622944,-0.5268323],
    [220,1,"CCOC(=O)C1(c2ccccc2)Oc2ccccc2C1N",0.47440547,0.27497494,0.29834414,0.08910069,0.6876175,-0.14481577,-0.084180444,-0.058359712,0.09515859,-0.14024797,-0.042016804,-0.08192328,-0.39865205,-0.61788845,-0.041863732,0.56002617,-0.31303054,-0.52411497,4.69e-05,-0.2694305,0.37469175,-0.6696329,0.57348275,-0.63788754,-0.49271986,0.016364185,-0.06308099,0.60471,-0.10674537,0.5502389,0.50615436,-0.39092165,-0.112443306,-0.5110728,0.6989665,-0.43422687,0.1819654,0.27898943,0.996773,-0.7455065,-0.9205482,0.28548133,0.090084,0.31165412,0.1500167,-0.86182487,-0.055111103,0.19063671,0.66995054,0.3510362,-0.073619016,0.427801,0.4027213,0.33845687,-0.83183086,0.41281217,-0.35156435,-0.034744542,0.41562077,-0.3655627,0.1667046,0.4563937,0.36276513,-0.3541729,0.38789383,0.54481095,0.06649157,0.2769645,-0.08699179,0.21900587,-0.6201212,-0.97753406,0.3696826,0.26065123,-0.4927897,-0.18800563,-0.09517535,-0.41005602,0.04982091,-0.99236846,0.15997048,-0.32813147,-0.94307965,0.000119304,0.30610678,-0.50997996,-0.35507658,-0.10690654,-0.32802612,-0.10688511,-0.07139901,0.12332283,-0.51296455,0.41848668,0.99739635,-0.38474065,0.07223688,-0.34203908,0.12081488,-0.17358713,0.3523743,-0.16730487,-0.08064689,0.5306044,-0.95104814,-0.68972254,0.21055746,0.45394862,-0.8239781,-0.028384041,0.46045715,0.29568827,0.199912,0.32635623,0.30208793,0.3985528,-0.17034681,0.50211555,0.9962589,-0.27663246,0.085900776,-0.44091332,0.1101021,-0.40837458,0.4132932,-0.44830632,-0.7743171,-0.07400317,-0.52731955,0.9993114,-0.087383546,0.39873585,-0.31394556,-0.07986849,0.17114232,-0.83566546,0.32929966,0.43646032,-0.3148212,-0.42538434,-0.99994636,-0.72031,0.87796617,-0.26748025,-0.054694347,0.22506624,0.113709554,0.5816157,-0.3006793,-0.22895461,-0.095286034,-0.7393565,0.39423805,-0.31812167,-0.6367205,-0.3223556,0.3456414,0.7825412,-0.6990123,-0.4187299,-0.92831767,-0.4294798,-0.63459116,-0.25142595,-0.49772424,-0.19105165,-0.04009557,0.621992,-0.25315937,0.44105718,-0.23443621,0.27594462,0.09445007,0.13863151,-0.23364021,-0.946307,-0.5628284,0.37318945,-0.621157,0.532581,0.6879425,-0.9559991,0.7457913,-0.23943153,0.15904853,-0.13117737,0.42189425,-0.23480906,0.1194967,-0.2654519,0.23863737,0.2594591,-0.4232793,0.15510361,0.007689961,0.49344662,-0.35920727,-0.45570123,0.045313355,0.5407812,0.49338904,0.024460621,-0.12403707,0.094835475,0.40859252,-0.27836618,0.28164145,0.28914392,-0.002355821,-0.99990684,-0.017944112,0.009627482,0.15903804,-0.13705644,0.43622953,-0.06186123,-0.673031,-0.10134728,0.60201037,-0.24079639,0.7943248,-0.11561725,-0.16590637,0.40852055,0.97274214,-0.2509904,0.015865164,-0.1281746,-0.07271243,0.23922758,0.020533575,0.5695555,0.72424906,-0.45758986,-0.15402158,0.32533526,-0.19384731,-0.512976,0.06613818,0.38850126,0.9230754,-0.607116,0.22279772,0.4125376,0.47682926,-0.40530115,-0.09164322,-0.12312946,0.3969698,0.80316734,-0.14150402,-0.73864347,0.025554003,-0.036072526,-0.2655428,0.18432003,-0.45934916,0.20675045,0.15722355,0.17869723,0.010805144,0.35547954,0.27470613,-0.46658444,0.29913813,0.56867,0.1286498,0.49905476,-0.9093779,-0.41572478,-0.3337644,0.9264926,0.011446377,-0.10068288,-0.3393118,-0.45570424,0.31396255,0.19820666,0.5154232,0.000901237,0.086187005,0.998245,-0.23926859,-0.29750678,-0.6164727,0.22230752,-0.001987366,0.34541216,0.08752035,-0.54157484,0.58581245,0.98042023,0.014737771,0.7705142,0.13660464,0.12761685,0.9999975,-0.95720875,-0.06545358,-0.51192594,0.21571857,0.48569474,-0.273594,0.27787858,-0.6916879,-0.6569936,-0.47712687,-0.2154401,0.16818981,0.18839619,-0.07380504,-0.4287946,-0.30775225,0.06931834,-0.09037828,-0.1482445,-0.21157187,-0.2617167,-0.9921906,0.08383426,-0.32064512,0.10696768,-0.21528406,-0.538745,-0.14776446,0.2751737,-0.3104461,-0.80840665,0.2599308,-0.05554678,0.5685707,0.22654037,0.23595533,-0.6158078,0.35048756,-0.15987247,0.05300783,-0.31320262,-0.09296613,0.57985127,0.50167906,0.06145243,0.2481194,0.7568469,0.4081662,-0.19071043,0.2529257,0.40964094,0.13206601,-0.3485576,-0.96706647,0.43560365,0.48016876,-0.005655884,0.19481525,0.10042714,-0.13683118,0.9999143,0.2290332,0.42782956,-0.12177436,-0.52721804,0.067848794,-0.7911765,-0.803579,0.39719895,-0.29677942,-0.18733737,-0.26012164,0.35105297,-0.29387367,-0.77679735,0.6036725,0.15510356,-0.057652924,-0.9933783,0.37320817,0.5601411,0.21624231,0.14521565,-0.51012826,-0.34600747,-0.41109845,0.086286075,-0.09150526,0.18357784,-0.29517272,0.41632673,0.32415706,-0.5953138,0.53534424,-0.2231974,0.34311956,0.40426067,0.24030298,0.10800735,0.00525565,-0.5154846,0.8218067,-0.22374715,0.27555117,0.5879106,0.011686029,0.7627185,-0.13458759,-0.19375591,-0.6290496,-0.64310586,-0.10824856,0.38478008,-0.5490409,0.5055268,0.014924514,0.15646192,0.48315698,0.13138276,0.99998724,-0.7700983,-0.9779859,-0.3851526,0.9995355,-0.45507517,-0.36207092,-0.99809295,-0.16100599,-0.26030052,0.5026846,0.13562346,-0.14675732,0.5732396,-0.30947983,0.28429097,-0.33909523,0.29350078,-0.03384168,-0.6536837,0.11233671,-0.57164186,-0.9999573,0.99999976,-0.86379766,0.7247435,-0.51567596,0.23289299,-0.21351732,-0.63728994,-0.77627915,-0.27109098,-0.12866345,0.17329887,-0.68167645,-0.416076,0.15855795,-0.44454187,0.26117012,0.16131113,-0.27065372,-0.027501626,-0.9998638,-0.5527153,-0.072372936,-0.41110927,-0.51890594,-0.1900474,-0.7651086,0.307613,0.5620713,0.21916033,-0.29511806,0.28000808,0.32193983,0.95565134,-0.2642694,0.75581336,-0.1299945,0.3153349,0.65047085,0.003944629,-0.41377732,-0.15548503,0.24231686,0.280097,-0.5788375,0.49743986,0.16794433,0.09748637,0.38997948,0.6280861,-0.34688765,0.52378595,0.09643256,0.1908622,0.4593744,0.9801909,0.21354355,-0.04550672,-0.25552565,-0.10117306,0.3537586,0.99985695,0.46763146,0.3368591,0.20193435,0.0817131,-0.4091407,-0.08572499,-0.9762006,-0.6879293,0.6092084,-0.108520605,0.7278479,0.4551118],
    [221,0,"Cc1cccc(N=c2cc(Cl)[nH]c(SCC(=O)O)n2)c1C",-0.40971154,-0.40171212,-0.6459679,-0.5802542,-0.42609394,0.27750385,0.65760654,-0.511269,0.34829158,0.43473813,-0.63159025,-0.5487384,0.1734044,-0.49675766,-0.16259159,-0.65968263,0.45046473,-0.11162544,0.19529317,0.076983385,0.51414466,-0.18634406,0.25474784,0.35787654,-0.7700603,0.6827236,-0.37460196,0.1679882,-0.4687227,0.62052447,-0.25890967,0.19924821,-0.60368896,-0.61982197,0.41413307,-0.4137251,-0.11202684,-0.14953293,0.9945172,-0.70910865,-0.84971356,-0.28071347,0.83854395,0.04745808,0.38376138,-0.6650743,-0.0495189,0.8573512,0.39151856,-0.16402723,0.11893921,0.007603383,0.69545853,-0.900512,-0.22261517,-0.25241712,-0.4051047,-0.112589024,-0.18556519,0.21101424,0.314754,0.2665603,0.39114785,0.13706776,-0.6063091,-0.19406588,0.43734568,0.14728582,0.6014227,0.3398344,-0.99726975,-0.9609701,0.23254593,-0.77374166,0.0814779,-0.48400384,0.6985614,-0.64693105,0.115625374,-0.99920285,-0.6259585,-0.7322172,-0.88724333,0.15781005,-0.1995434,-0.6382404,0.10120009,0.73151296,-0.40559265,0.4201621,-0.084687635,0.12067085,0.7819053,-0.17207819,0.99923134,-0.28771302,-0.25373346,0.8537229,0.5907418,0.36616454,0.37922072,0.6134888,0.45325118,0.76988983,-0.96924293,-0.72422945,-0.40188056,-0.4553379,-0.9999786,-0.20869197,0.42197692,0.044558343,-0.73598766,-0.1774792,-0.28878433,-0.2527857,-0.28917867,0.36046758,0.9958683,-0.76110315,0.55596894,0.28307897,0.658348,-0.1878153,0.012261059,0.2572853,-0.24868938,-0.6337735,-0.040689226,0.99921656,-0.13113919,-0.029779473,0.099601254,0.47596845,0.44871405,-0.9432823,-0.1664465,-0.3858315,-0.77158624,-0.5283463,-0.99997354,-0.47326428,0.7506262,0.035343137,-0.36832148,0.6414297,0.1893632,0.1467908,-0.5953619,0.33687237,-0.06557342,-0.28396398,-0.08974418,0.5506266,-0.58689153,-0.23024724,0.039409976,0.64810103,-0.5562716,-0.08380466,-0.9011919,0.46008313,0.06276648,0.56441087,-0.25041276,-0.7092459,-0.043114513,-0.06818107,-0.150573,0.42787874,-0.34136623,-0.43747547,0.23139751,-0.17828086,0.5941593,-0.1923767,-0.49680567,-0.6394718,-0.5847553,-0.17938611,-0.12898414,-0.93624973,0.19255576,-0.12986603,0.067205384,-0.23209256,0.051659014,-0.40002716,0.35221368,0.6946795,0.5143778,0.6185054,0.41751745,0.46631688,0.2060662,-0.26341233,0.14946648,0.052262764,-0.2859619,-0.53985614,0.14632379,0.37280557,-0.051420253,-0.12942109,-0.9198243,0.17823839,0.09399543,0.03519201,0.3542561,-0.99930924,0.76846075,0.2889076,-0.38551214,0.8609431,0.22854748,-0.23074128,0.25304228,0.7423693,-0.18922254,0.41205665,0.48973683,0.46079648,-0.5136201,-0.21888559,0.9863643,0.73939675,0.4720372,0.17444552,-0.3030409,-0.4100738,0.36229846,-0.5213738,-0.32951474,-0.509862,-0.4954097,-0.36205515,-0.50387156,-0.4880193,0.06178182,0.18425092,-0.9818078,-0.16441603,0.007776924,-0.36437768,0.07740008,-0.38859764,-0.39616272,0.89087784,-0.29009247,-0.28715143,0.6060212,-0.976121,-0.26159388,-0.23503649,0.6486632,-0.46906173,0.52910304,0.67812777,0.022137756,0.27852,-0.31829438,0.7129956,0.5228003,-0.2361076,-0.13085277,0.27962542,-0.08030211,-0.26315796,0.90030503,0.21897775,-0.18913311,0.997692,-0.20214927,0.18149567,-0.20173676,-0.16010644,0.32968548,0.13700704,-0.42024508,0.15242064,0.3711444,0.99683595,0.15496427,0.48810992,0.1311654,0.45262107,-0.5355579,-0.63904274,-0.85860664,-0.4223482,0.24344397,0.96827996,-0.8614931,0.73506755,-0.22260943,-0.017373487,0.99998313,-0.9515267,0.17975505,0.37921998,0.44190797,-0.50642574,-0.6945526,-0.76526093,0.4974681,0.4213009,-0.67533344,0.7378677,0.29944527,0.26896653,0.5424536,0.51693356,-0.09094203,-0.39236286,-0.17729712,-0.39655063,-0.46220714,0.17988604,0.97489333,-0.5309627,-0.25093552,0.53675306,0.6068875,-0.09768383,-0.43770078,0.1318889,0.33196813,-0.8209925,-0.016002731,0.47658744,0.34419897,-0.36506066,0.511724,-0.003881159,0.10822045,-0.16460674,0.25939634,0.6488345,-0.006457801,-0.16305447,0.39900935,-0.26519507,-0.4260304,-0.28380388,0.19779083,0.28516433,0.7564245,-0.6439318,0.65151817,-0.5002134,-0.9306881,-0.5201018,-0.5888622,-0.21506213,-0.006617609,0.27364096,-0.6371216,0.99967533,-0.8332864,-0.13902692,0.30419582,-0.39220464,-0.5962603,-0.52499545,-0.6268906,-0.014014475,0.72195554,0.47073078,-0.34403992,0.47760382,-0.51499957,-0.013274077,0.43617448,-0.8491493,-0.38594207,0.99480534,-0.25894275,0.3229019,-0.5681668,0.73026407,-0.34430498,-0.2521035,-0.23037182,-0.22255793,-0.55099005,0.65263295,-0.32791498,-0.2834406,-0.71181995,0.8244593,-0.23116174,0.4763827,-0.7701941,0.2629328,0.4836148,-0.503065,0.22160655,-0.014609692,0.25306824,0.14037004,0.4562196,0.2755471,-0.3759889,0.31583142,-0.025841769,0.092350535,0.32214308,-0.31647897,0.6302374,0.5835983,0.21471001,-0.27021182,-0.2988169,-0.02770856,-0.0788521,-0.18498087,0.92348105,0.5786051,-0.9910775,0.6000966,0.9983802,-0.40047336,0.11253946,-0.96269345,-0.022063788,-0.2239353,-0.13720083,0.11903869,0.1862727,0.5949466,0.65533924,-0.23755795,0.115191594,-0.42811388,-0.13583636,-0.17597638,0.4513168,0.606623,-0.99997705,0.99820805,-0.80795205,-0.538592,0.48861495,-0.750167,-0.32658046,-0.065230235,-0.7296163,0.46503446,0.55838627,-0.79966533,-0.56902987,0.10020569,0.605903,0.04742364,0.81473905,-0.47569108,-0.004397967,0.21381111,-0.99982125,0.34720477,0.04134669,0.26470074,-0.006610233,0.26554453,-0.66283345,0.67747444,-0.002957469,-0.7002683,-0.12183001,0.056566402,-0.7644971,0.99404407,0.6137787,0.71500254,-0.6536173,-0.107106484,0.24178286,-0.69672656,0.44115564,-0.5653434,-0.19106904,0.31371894,-0.5506732,0.052292395,0.63112324,-0.09681672,-0.23206855,0.26268435,0.19640233,0.6402026,0.22012295,-0.41638187,0.11158848,0.9829002,-0.8093645,-0.51701254,-0.48811513,0.16351223,0.1726305,0.9999776,0.7633089,0.3832398,0.21275976,-0.20325887,0.43229997,0.21049988,-0.9947715,-0.4242295,0.84814924,-0.23182836,0.1384789,-0.59321815],
    [222,1,"CCc1ccc(O)c(C(C)(C)C)c1",-0.77686965,-0.5093426,0.038442776,0.16327423,0.3562186,-0.02961614,-0.472691,-0.34197307,0.15247732,-0.63189167,-0.82084703,0.3412833,0.12005219,0.25946903,0.2792765,-0.4673739,-0.5533887,-0.39295992,0.24239078,0.047047414,0.18927947,-0.6875389,0.5819564,-0.11293258,-0.14072163,0.67108905,0.18926461,0.40287027,0.5601909,-0.3242994,-0.50440925,0.49408895,-0.38247293,0.15702245,-0.05980973,0.40965918,0.31861898,0.3881195,0.5856048,-0.897199,-0.99329585,0.001982393,-0.038859818,-0.4488511,0.10953965,-0.99423796,0.27428347,0.18278109,0.954179,0.35336,0.5811366,0.21126868,-0.05632357,0.22970718,-0.9614699,-0.2143065,-0.5779898,0.87907535,0.45769498,0.064439975,-0.27458012,-0.5218295,0.42153838,-0.18648516,0.006504196,0.31178194,0.28806686,0.6595948,-0.09433707,0.6123351,0.720255,-0.90288585,0.27938277,0.33003798,0.8673964,-0.21239339,-0.009371858,0.17114839,0.24618721,-0.99778885,-0.6034218,0.5636546,-0.8335459,-0.090055026,0.115162276,-0.5508683,-0.000885621,-0.1123818,0.511097,-0.24934389,0.012733523,0.27164996,-0.16794375,-0.34979892,0.079520196,-0.0925099,0.6513318,0.3630453,0.22835745,0.03191672,-0.06867701,0.5270608,-0.2989009,-0.7060671,0.6955602,0.43460962,-0.020609494,-0.14750238,-0.9206758,-0.42932764,-0.39781076,0.30996227,-0.14429703,-0.562247,-0.10736796,0.64811337,0.25999323,-0.07299359,0.9994826,-0.22765177,0.32308117,0.35763377,0.24163714,0.19170488,0.17145377,-0.043418273,0.20641203,-0.3320231,-0.15767775,0.9998294,-0.3626996,0.19589101,-0.06342591,-0.056785624,-0.16492626,-0.7350983,0.4550451,0.81074214,-0.80464745,-0.2674531,-0.99885786,0.2758437,0.9970393,0.625312,-0.18316852,-0.16994609,0.15912141,-0.61993617,0.98447204,-0.28488877,0.06083249,-0.81292653,0.11735098,0.27868068,0.2394045,0.3189054,-0.5023963,0.9976298,-0.7588133,-0.6019417,-0.9917139,0.027750917,-0.091555715,-0.22457133,0.27525797,-0.18271832,0.63497204,-0.23890457,0.08356321,-0.19110215,-0.8127417,-0.54340166,0.46813238,0.06343898,0.03901417,-0.9738057,-0.7827117,0.5371905,-0.6957901,-0.050574437,0.028312804,0.56015605,-0.5517936,0.27185065,-0.7967346,-0.33498555,0.41401297,0.2155221,0.098470114,-0.66827995,0.7447022,0.44877094,0.28623646,0.5561507,-0.2817259,-0.08246708,0.37419972,-0.59357685,0.117319494,-0.1764982,-0.51756924,0.055443387,0.2048917,-0.013654072,0.15102644,-0.47964597,0.093831725,-0.25987336,0.08115657,-0.9784317,-0.36690292,-0.27999562,0.06712816,-0.2802515,0.50708467,0.24451502,-0.31273815,0.106336184,-0.2874327,0.3161109,-0.12082706,-0.07825433,-0.30911312,-0.6812282,0.9938141,0.28484344,0.13886732,0.08071287,0.022287587,-0.36291096,-0.44480455,-0.18197462,0.5716804,-0.11629981,-0.3904145,-0.45873904,-0.33530352,0.23003463,-0.43289226,-0.023272267,0.9281037,0.58322597,0.041704763,-0.6982143,0.19368455,0.07742545,-0.23172805,0.18820734,-0.4913287,0.033303738,-0.17313856,-0.9986134,-0.6059243,0.41803014,0.36097923,-0.65131617,-0.13054985,0.2597231,-0.41273975,0.10194113,-0.3047986,0.5623999,-0.23012842,-0.4934144,0.79085857,-0.46809587,0.020730427,0.1687611,-0.27168044,0.577133,-0.5257373,0.42492655,0.3510899,0.06328976,0.016690196,-0.6539418,-0.4063086,0.08829086,-0.2126095,-0.39941084,0.51562977,0.9997146,0.098167,-0.15988457,0.052544307,0.058671393,-0.21894519,0.24534546,0.68963796,-0.059073754,0.06848631,0.9992811,0.008768362,0.9222874,-0.21459791,-0.33381605,0.99878854,-0.9922826,0.08209677,0.14393535,0.15226567,0.15087913,-0.25260183,-0.18772231,-0.07078795,-0.8860792,0.98523366,-0.004651237,-0.40638655,0.10919831,-0.36507297,0.27625045,0.28339478,0.03955481,0.92519474,-0.5360284,-0.35094962,-0.10297535,-0.96107167,0.38992846,0.4674189,-0.01889485,0.7436491,-0.6325471,-0.30033565,-0.5342467,0.49501118,-0.96621245,-0.18186791,0.46102688,0.17284673,-0.55565804,-0.1946998,-0.38005134,0.2639697,0.61820006,-0.1266263,0.382961,-0.027572796,-0.11952892,0.12358036,0.3401719,0.4495695,0.12203763,-0.24100384,-0.029576143,-0.3577541,-0.5817232,-0.12729074,0.86162984,-0.9962299,-0.18567656,-0.7404307,0.043264106,0.26078913,-0.44537506,0.37468845,0.99934536,-0.22883897,-0.41672474,0.21926151,0.32441583,0.062146284,0.40678737,-0.81578726,0.1873926,0.4500562,0.058979034,-0.30192617,0.29837856,0.6560684,0.000340178,0.3549812,0.8926761,-0.03264167,1,-0.0542938,-0.10926315,0.111088485,0.15218917,-0.86924547,0.3743956,-0.44077116,-0.3464267,-0.706899,-0.47236526,0.0642214,0.77145535,0.4512094,0.7624532,0.09736105,0.12648138,-0.09487682,-0.07521142,0.048041463,-0.6476922,-0.03850869,-0.2579066,0.8959867,0.030618554,-0.97711694,0.5895126,-0.048484858,0.29868189,0.010399889,-0.3077343,-0.2157859,-0.6795952,-0.44100997,-0.28987235,0.3244725,0.4912298,-0.40163642,0.45756757,0.13491203,0.16129616,0.99990517,0.09839351,-0.97732127,0.21704309,0.99978787,-0.33311927,-0.5284668,-0.9982975,-0.44339445,0.7425023,0.6695788,-0.07414466,-0.42741877,0.3425242,-0.074088514,-0.53909045,-0.6272219,-0.43128428,-0.2559313,-0.35398668,0.05434119,0.06045089,-0.9999766,-0.99873656,-0.9917941,-0.4597527,-0.043842673,-0.22161971,0.119370565,-0.62191343,-0.78031605,0.19170256,-0.5652041,-0.2727277,-0.69216806,-0.509736,0.30851442,-0.22110307,0.7083587,0.090940796,0.19970897,-0.9724524,-0.9999698,-0.70761913,-0.3708696,-0.23178147,0.30915645,0.2897478,-0.99482334,0.21847263,-0.57116675,0.13785343,-0.5035614,0.33264047,-0.55684066,0.9532538,0.09835154,0.62806726,0.18752186,0.6766185,-0.45214128,-0.8034512,0.3452688,0.44999847,-0.62140757,-0.3167695,0.26883423,-0.47270802,-0.2749517,-0.1724877,0.18370995,-0.5194616,-0.06699765,0.57183117,0.042119093,-0.17537287,0.307229,-0.58342296,0.02450661,0.27015078,-0.017265286,0.28799394,0.594124,0.9994968,0.4539164,0.007878794,-0.46123266,0.44346765,0.120654196,-0.25020346,-0.24264535,-0.5906011,0.04580148,0.6099833,0.7578413,-0.014659035],
    [223,1,"CC(=O)OC1(C(C)=O)CCC2C3=CC(Cl)=C4CC(=O)C5CC5C4(C)C3CCC21C",0.7590208,0.1943429,-0.48446208,-0.025083285,-0.50788933,0.4637413,-0.17201607,0.41948172,0.3646333,0.09510081,0.3576833,0.0311565,-0.2581142,0.6538393,0.08544517,0.158752,0.037344746,-0.59784883,-0.13710444,-0.6537632,0.3310101,0.27882728,-0.38205355,-0.25599992,-0.3356802,0.6100947,-0.4150526,-0.6008175,0.36632523,0.16900149,-0.09263293,0.3889304,0.31766206,-0.86906976,0.3765651,-0.12203055,0.3495708,-0.49500597,0.9998776,0.2920457,0.6873224,0.09729024,0.13431735,-0.3432291,0.5320581,0.91283524,0.5925563,-0.38270327,0.99542624,-0.910654,0.12901562,0.7042583,-0.32130057,0.006983826,-0.4046002,0.04969892,-0.2815563,-0.94516104,0.37147,-0.5839924,0.095094964,0.430524,0.6441996,0.15254773,0.30129716,0.26080984,0.87419826,-0.5295048,-0.33345002,0.60843927,0.09184021,-0.3236486,-0.38894767,0.9089335,0.1587954,0.84798396,-0.24797827,-0.29288474,0.037971947,-0.99995476,0.12820902,-0.30266964,-0.8418715,-0.71722347,0.04121745,-0.92663544,0.42788208,0.40924928,-0.7304384,0.36785024,0.009032235,0.39981058,0.16206281,-0.073688865,0.9987929,-0.058200262,0.5057782,-0.32988194,0.13617153,-0.57720864,0.23097566,0.61480576,0.36895886,0.7629565,-0.99991024,0.06904411,-0.55982125,0.016474364,0.9814926,-0.22654285,0.035913497,0.25354028,0.39293435,-0.641109,-0.104230575,0.05065722,-0.24769896,0.4185122,0.4972306,0.13003798,0.3280189,0.57901156,-0.6198106,-0.6161722,0.14737982,0.029794091,0.5398855,-0.13226688,0.27149063,0.9998735,0.25984898,-0.07514694,-0.006469617,0.16240709,0.4849014,-0.9723202,0.6682951,0.03469018,0.5158053,-0.45000905,-0.9999707,-0.41687405,-0.19556923,0.4922376,0.554262,-0.70772845,0.007439687,0.5284152,-0.9997679,0.44605824,0.48833346,-0.95508397,0.87779945,0.37861842,-0.090110056,-0.44412315,-0.4715336,-0.9919854,-0.8105568,-0.92127776,0.39421764,0.10606192,0.25616884,0.24448515,-0.5609553,0.4229224,0.52332926,0.156104,0.06922518,0.57974476,-0.5280753,-0.25544807,0.35935327,-0.19479631,0.20349132,-0.87299323,0.86283547,-0.38246888,0.124532185,-0.09607409,-0.15174642,-0.9590384,-0.16257161,-0.4228157,0.94715184,0.038336728,-0.34754243,-0.76417094,-0.29540083,0.29257694,-0.7079836,0.40024203,-0.69698924,-0.63866836,0.2852928,0.23967755,-0.85600436,-0.8128201,0.3604314,0.039030254,0.35279644,0.23637453,-0.38016078,-0.62815684,-0.5677467,-0.113954805,-0.1188508,-0.63131696,0.43275645,-0.9999739,0.40477526,-0.67081785,0.1417027,-0.8223451,0.07651807,0.031910095,0.005387394,-0.28393358,-0.28044206,-0.010169465,-0.017206728,0.41831,-0.7819907,0.026748668,-0.9024272,-0.17165178,0.6075873,0.117417745,-0.8096978,0.17288214,0.6653831,-0.31540477,0.03229926,-0.1956435,-0.20944366,0.5366621,0.43428487,-0.1684338,0.45589036,-0.33173946,0.9144621,0.64534146,0.55269814,-0.07410427,-0.8555445,0.2532256,-0.28744036,0.245139,0.17666961,-0.693019,0.23766147,0.21788386,0.59265906,0.10057046,-0.51279455,-0.7097455,0.1690792,-0.51795393,-0.25167367,-0.17283526,-0.18328738,-0.13952376,0.034522418,-0.7709531,0.8380952,-0.25435162,-0.14144868,0.119203545,0.9550547,0.28544477,0.08016321,0.999951,0.41401577,-0.19777365,0.062059402,-0.5682609,0.45016906,-0.87869453,0.1668014,-0.75083286,0.7635458,0.88297254,-0.77935714,-0.45330378,-0.27375665,-0.16397716,0.5125559,0.9691131,-0.11594398,0.11209919,0.48628816,-0.7562297,-0.6387297,0.54027116,0.08627974,0.42658645,0.999999,-0.99035335,0.49253473,-0.7870961,-0.12547384,-0.27136296,0.21934772,-0.6536209,-0.7873287,-0.97226727,-0.9991157,-0.65990615,-0.3848193,0.03971043,0.5017742,0.016418802,0.32658824,-0.7366172,-0.3597367,0.091137946,-0.02596828,0.13522074,-0.99977726,-0.565769,0.21954146,-0.44728792,0.7008521,-0.62451565,0.33955777,0.000632094,-0.08679785,-0.7725051,0.15643793,0.21221262,0.065499514,-0.37369466,0.49280414,0.16777878,0.07785467,0.7817957,0.46249416,0.32676828,0.13232048,-0.37081984,0.6323159,-0.5810803,0.58092594,-0.49845386,-0.3979513,0.32722417,-0.6991171,-0.016181625,0.60317,-0.9881007,0.09095119,-0.18898995,0.49836123,-0.2374454,0.22480172,0.69979274,-0.86259335,0.9992233,0.21174832,0.24738376,0.6642866,-0.20230864,0.1676438,0.291334,-0.9140593,0.2524444,0.6392085,0.9431806,0.7018728,0.23488308,0.17234856,0.30996147,0.8124174,-0.704228,-0.46103564,-1,0.64818573,0.15353592,0.4668748,-0.74075884,-0.35869274,-0.721231,-0.30261004,-0.33204937,0.03753796,0.062146064,-0.39531344,-0.44902384,0.07409544,-0.7877333,0.64397746,0.36766592,0.1260864,0.22202724,-0.22397491,0.5234709,0.035237953,0.085739434,0.66963696,-0.17199399,0.936477,0.78278303,-0.27075598,-0.7616026,0.21506564,-0.24755262,-0.6529346,-0.36587638,-0.34021887,-0.25927603,0.15553157,-0.49737263,0.6826834,-0.34970903,0.24842347,0.73434705,0.99999833,0.5903358,-0.9652418,0.46839362,0.9960147,0.2899685,0.25933576,-0.9999499,0.7091833,-0.6420545,-0.4424165,-0.25994438,-0.28126922,0.043951664,-0.119126566,-0.81634945,-0.46223804,0.3861197,-0.40485322,0.31089777,0.24752511,0.33659142,-0.9996756,1,0.832645,-0.54917485,0.62062716,0.696745,0.18723173,0.22645089,0.75743216,0.40524048,-0.70405775,-0.18486248,-0.30736247,-0.41929334,0.3053639,-0.29908338,-0.17261232,-0.5999792,-0.112780124,0.9876292,-0.9924969,-0.6293338,-0.32072183,-0.21486533,0.34673774,-0.21619287,-0.39128146,0.16307816,0.58502215,0.6154125,-0.20097622,0.71006566,0.42021918,0.46791103,-0.7441871,0.5226554,-0.23782521,-0.1424156,0.25896844,0.7373197,-0.0198657,0.08599439,-0.64912105,-0.54319715,-0.9996713,0.57680845,-0.1414403,0.59030306,0.016263565,0.20113532,0.3029981,-0.9736378,0.24065268,-0.60013443,-0.18005933,0.9996782,0.47078705,-0.08398326,0.08772727,0.4937072,-0.17636739,0.9999241,-0.078974225,-0.31518784,0.03274022,0.7578794,-0.14877364,-0.4477786,-0.99984497,-0.3084836,0.049961936,0.80513227,0.8421475,0.059225034],
    [224,1,"CCOC(=O)COc1ccc2c(c1)CC(NCC(O)c1cccc(Cl)c1)CC2",0.05041712,0.54705346,0.3120015,-0.6074889,0.12150086,-0.07853171,0.009141393,0.08291498,-0.1406499,-0.40422767,-0.37120762,-0.07402273,-0.30939266,-0.583914,0.5427306,0.12166386,0.20770328,0.3174179,0.5459873,-0.15062168,-0.18165572,-0.36393476,-0.115131,-0.5251256,0.20291735,0.5329963,0.25011262,-0.11640312,0.4225523,-0.63290447,0.48164427,-0.6537668,0.33660328,-0.05372638,0.34006134,-0.094544366,0.7027218,0.2151361,0.9991524,-0.5016759,-0.2370126,0.01281172,0.1574942,0.28473148,-0.029626407,0.4950701,0.47261682,0.31239957,-0.5407746,-0.00198953,0.27516988,-0.07207759,-0.112907656,0.5431589,0.16146548,0.5645439,0.5167189,-0.6613518,0.766177,0.33076406,-0.5939889,-0.71272886,0.21619076,-0.1225115,-0.499646,0.07001661,-0.23265588,-0.14545271,-0.079746395,0.12016354,-0.9925236,-0.92906564,-0.061499543,0.41658705,-0.06002455,0.73864883,-0.14710213,0.32747743,0.1800595,-0.99715596,-0.20260485,0.11871114,-0.94013995,-0.64980763,0.001723535,-0.9384438,-0.5469695,0.3042013,0.01556909,-0.10363679,0.21700194,0.29671368,0.04798145,0.42490104,0.9991747,-0.02082887,0.63378847,0.63900816,-0.16742425,0.09657241,0.3532597,-0.14035109,-0.4235857,0.9826691,-0.99841,-0.35618395,-0.086595185,0.3670818,-0.999678,0.20697227,0.47487193,-0.30335006,-0.05355862,-0.13352576,0.18569364,0.75358725,0.3856747,0.7646575,0.89706373,0.70425534,0.48102483,0.42411208,0.59275943,-0.19922027,0.103495814,-0.26650482,-0.37629384,-0.54841435,-0.67163867,0.99921525,0.27468473,0.75178474,-0.039562825,-0.46863285,-0.03452484,-0.92578954,-0.01855208,0.15295343,-0.06575505,0.25563952,-0.9999989,0.08440156,0.4904979,0.8012971,-0.17724092,0.18757184,-0.55646867,-0.5367618,-0.98936564,0.6242205,0.7698426,0.2590739,0.5875091,0.003578982,0.10959058,0.39710903,0.35113505,-0.76902795,-0.49709752,0.8635552,-0.31691858,-0.39767238,0.55177736,-0.043042336,-0.027925499,-0.5003617,-0.7829517,0.28261864,-0.39167568,0.21451464,-0.029374236,0.3589832,0.5953347,-0.07934535,0.074486434,-0.91111857,0.31756407,-0.5115893,-0.614561,-0.32118967,0.6641796,-0.82179254,0.6956613,0.011115757,0.6967799,-0.057514843,0.526355,-0.22939058,0.026458943,0.6822435,-0.7684885,0.35254,0.44637948,-0.51124156,0.031099655,0.67842036,0.077148356,-0.8144695,0.7081745,0.5697654,0.113060445,-0.029506423,0.65391576,0.47530735,0.20329435,-0.4832296,0.663884,-0.63817894,-0.30718744,-0.9999217,0.17903055,0.106698126,-0.003960942,0.27867305,0.040666755,0.39319637,0.59596044,0.19726735,0.4003187,-0.32841003,0.044054486,0.5159413,-0.52526957,-0.35925084,0.99062353,-0.54754585,0.12932268,-0.5015808,-0.5649256,0.48007336,0.2344269,0.3924411,-0.43822762,0.31741765,0.5873691,-0.220905,0.39922604,0.07572492,-0.07168744,0.4932385,0.9417953,0.4916328,-0.13682978,0.11680178,0.010634496,-0.17785509,-0.73220396,-0.50230193,-0.21855192,0.08031417,-0.6168805,-0.8191228,0.1403496,0.6434444,-0.37301162,0.41517007,-0.15634994,0.30768478,-0.6012725,0.03546136,-0.34486502,0.009591329,0.42171237,-0.2760645,-0.41323453,-0.5258949,-0.54579955,0.79638577,-0.43703395,-0.20619386,-0.39368266,0.9969979,0.20464425,-0.066500634,-0.35217193,-0.7514057,0.48382658,0.29494902,0.059029445,0.42219803,0.5037104,0.9858452,-0.056731816,0.31567246,-0.21412838,-0.31033257,0.0327376,0.16421682,-0.97468936,-0.22075765,0.36723626,0.2745111,-0.66577035,-0.07895384,0.11236952,0.5411508,0.9999981,-0.9605665,0.19873038,0.32486892,0.3459358,-0.5524895,-0.44593766,0.34004638,-0.62597156,-0.77501166,-0.996871,-0.24617825,0.9366428,0.44048095,-0.6631386,0.62241715,-0.59659284,-0.30169508,0.1918744,0.70413345,-0.48136637,0.47951987,0.9472735,0.062179726,0.06172529,-0.11144683,-0.22871125,-0.2845124,-0.014705123,0.07551832,0.43116242,-0.75820416,0.27869153,-0.2782965,0.20333613,-0.3277315,0.27591953,-0.8304771,-0.08814998,0.069746934,-0.06510436,-0.598058,-0.21338916,-0.4158447,0.15868288,-0.4913747,0.103770085,-0.009140981,0.3707648,0.082860745,-0.3064111,0.26113138,-0.30070153,-0.9302169,-0.77368325,0.46615064,-0.03167881,-0.53764445,0.2448324,-0.37921676,-0.2581111,0.9998329,0.47203502,0.15995452,0.553539,-0.11857422,0.35668918,-0.55243456,-0.8618315,-0.39910248,-0.031041974,-0.42890403,-0.29947183,0.32369605,-0.26530668,0.5037474,-0.75082904,-0.56704175,0.41604817,-0.99241376,0.8477441,-0.23481181,-0.26295567,-0.4473877,0.73378366,0.5099258,0.70707995,-0.57633716,0.58129877,-0.026321646,0.39461395,0.132114,-0.22936934,-0.82856745,-0.09368519,0.51005656,-0.7665901,0.15839735,0.74966425,0.4857606,0.44954664,-0.09398385,-0.8541562,-0.28865224,0.8501397,0.40404123,-0.4157871,0.19031449,0.06713509,-0.10264692,-0.29022887,-0.7728743,-0.2872683,0.7100109,-0.694436,-0.048596483,0.16095024,-0.3691303,0.62101096,0.71695447,0.93737894,-0.20757273,-0.90829724,0.4495051,0.99956214,0.18192355,-0.17266503,-0.9822262,0.5619039,-0.8587334,-0.787603,-0.0997674,0.19401763,0.6550862,0.4387417,-0.37738773,0.20171812,0.40324032,0.53845364,0.024491739,0.19134559,-0.000604602,-0.99990535,0.9999999,0.74169695,-0.5444127,0.1671506,-0.6277458,-0.5652595,-0.4630088,0.5545909,0.4543452,0.34593335,0.031904735,-0.47689602,0.25406334,0.6929559,0.003219426,0.40505242,-0.34969923,-0.49432063,0.97040313,-0.9989882,-0.15502167,-0.47217718,-0.47571534,0.101783685,-0.6080217,-0.767445,0.30046493,0.061427,0.07761567,-0.09376459,-0.27470475,-0.8569965,0.98306847,-0.24069917,0.62295777,-0.12671359,0.8062817,0.03153729,-0.5357939,0.09554591,0.029695407,0.67117125,-0.35826826,0.21289214,0.114711024,-0.46308148,-0.34543893,0.82661724,-0.0682207,0.76614445,0.19003564,-0.5755496,-0.13113718,-0.34361115,0.999449,-0.16482924,-0.7523712,-0.05066897,-0.33716083,0.8189147,0.99998915,0.7259071,-0.03944438,-0.2533246,-0.3126226,-0.2810477,0.11569491,-0.99827754,-0.091808006,0.10837473,0.054814763,0.5759556,-0.40530384],
    [225,0,"Cc1ccc(N)cc1N",-0.7492155,-0.3014666,0.5458157,-0.16811222,-0.25759566,-0.20815445,-0.5567169,-0.27743107,-0.043766428,0.24619353,-0.8346288,-0.6869402,0.20170599,-0.61490613,0.17575984,0.4915766,-0.34968916,-0.25734115,0.2096686,-0.075349376,0.5352288,-0.91740346,0.6275299,0.3933906,0.35742977,-0.10156305,0.119304456,0.45481363,-0.1428871,-0.17667389,0.06391073,0.5200454,0.23416182,-0.19732787,-0.43866473,-0.23063968,-0.25906885,0.5690489,-0.77540886,-0.91134346,-0.9379303,-0.46590275,-0.595027,-0.4492309,0.2139176,-0.996838,0.51198304,0.085607424,0.77862537,-0.50429606,-0.0547759,0.24152303,0.03199436,-0.017783513,-0.9468479,-0.42988363,-0.58242154,0.9681662,0.5549752,0.12264163,-0.35338512,0.1052847,0.12724403,-0.58708674,0.7697601,0.6442321,0.02429185,0.42608553,-0.01817236,-0.06808085,0.19577527,-0.9957898,-0.24393979,0.16148561,0.22832824,0.32386246,-0.3459191,-0.40818378,-0.17391767,-0.96245426,-0.8920016,0.5231998,-0.91700786,-0.24853611,0.46363673,0.7146814,0.19936825,-0.004683214,-0.08180097,-0.39909378,0.0327636,0.1926737,-0.17840034,0.1955335,0.6563402,-0.37496233,-0.63142645,0.063275814,0.5572204,-0.3762235,-0.028455814,-0.65527856,-0.006714998,-0.82776135,0.98886776,-0.024135873,-0.16188905,0.27000618,-0.99910206,0.14349858,-0.2627135,-0.24624923,0.061917264,0.35034347,-0.18028675,-0.2675717,0.38344157,0.094310634,0.9979909,-0.28148836,-0.38001618,-0.5330915,-0.18238935,-0.3610673,0.047835138,-0.17867431,-0.51992095,-0.16638297,0.002256635,0.99657565,-0.15158613,-0.07035008,-0.15793398,0.136002,-0.26660538,0.8034255,0.48942438,0.32537693,-0.6492596,0.017444886,-0.9825316,0.21873242,0.9813599,0.13065204,-0.005557561,0.6019946,0.40687978,-0.53769416,0.99788666,0.07481184,-0.08224512,-0.32213682,-0.48246363,-0.17613056,0.07888518,0.021791153,-0.6222742,0.99907434,-0.16821194,-0.26781663,-0.9904248,-0.20768474,0.28105938,0.2141692,-0.41683608,0.17388962,0.8621762,0.09426341,-0.048157476,0.014777228,-0.682472,-0.23147707,0.42499006,-0.7418161,-0.07903029,-0.96688986,-0.8233428,-0.21245262,-0.52487946,0.27330986,0.66192806,-0.55240583,0.21172707,0.060687743,-0.8174308,-0.6042151,0.531247,0.005772699,-0.13400525,-0.31945986,0.93799615,0.1812881,-0.17881203,0.13859226,0.345262,-0.07448146,0.29023066,0.5005999,-0.5746825,-0.46299967,-0.049051214,-0.26353356,-0.6495465,0.06505308,0.3233242,-0.083004564,-0.11097456,0.33171186,0.28532785,-0.16610329,0.13518374,-0.12287069,0.031031186,-0.5625793,0.103281625,0.011666009,0.4469595,0.096293524,-0.042328857,0.16231029,-0.005265503,-0.4096509,-0.24098025,-0.020740233,0.99998885,0.12541783,0.1786058,0.019883836,0.31587008,-0.6964776,0.100960284,-0.6294273,0.39527142,-0.3387109,-0.033116203,-0.38445315,-0.6885703,0.33783436,0.37964898,0.49243388,0.9113085,-0.10308053,0.07241478,-0.096021555,0.57604325,-0.19658269,-0.30011788,0.63735265,-0.38143843,-0.14320149,-0.2639072,-0.99686205,0.6397923,-0.36979818,-0.22825111,0.16149883,0.29654667,0.06792273,0.08545558,-0.11534906,-0.7132692,0.41350582,-0.022331119,-0.3377994,0.493511,0.116052024,0.24010526,-0.14387298,-0.9989094,0.41300905,0.12902516,-0.7186476,0.052655693,0.64318043,0.09881947,0.6116742,-0.31575552,0.27359214,0.3056191,0.7227097,0.18282114,0.9985876,0.34073126,0.6178372,-0.13639025,0.1209982,-0.33301058,-0.812344,-0.69039273,-0.04771912,-0.24912041,0.9989779,-0.060332943,0.8443737,0.19143775,-0.007081247,0.9956543,-0.6383551,0.40665478,-0.15884094,-0.017628776,0.56673145,-0.42846087,-0.23033708,0.38095012,-0.49250808,0.99923563,0.32335654,-0.53218406,0.10621458,0.18883625,-0.20936726,0.23837914,-0.6669549,0.70407635,-0.46652994,0.08320793,-0.24448039,0.77939886,0.024588192,-0.10197248,0.38406706,-0.19668685,-0.4158434,-0.57182086,-0.03353686,0.52735883,-0.7886375,-0.08915418,0.0983031,0.35065928,-0.243413,0.52383107,-0.036125585,0.10708563,-0.45772597,-0.13495402,0.08089446,-0.6637892,-0.3389188,-0.000648694,-0.26124105,-0.40980506,0.12321001,0.23074737,0.640515,0.008017316,-0.37989277,0.3554896,0.9597753,-0.9926508,-0.15494157,-0.4626198,-0.24573112,-0.06790521,0.22023118,-0.07970987,0.9749298,-0.06716845,-0.42293352,-0.04872633,0.20181637,0.43588635,0.001438859,-0.42556,0.054443642,0.24211074,-0.5388824,-0.48376137,0.36048597,0.32009035,-0.18857326,0.5202607,0.962616,0.13993369,1,0.07627822,-0.15531813,0.17470184,0.32055888,-0.81195956,-0.44857994,-0.12564051,-0.6459357,-0.33933052,-0.35084838,-0.53307843,-0.31236506,-0.08954122,0.7326641,-0.017316027,-0.11049267,0.6574953,0.19554874,-0.5817479,-0.22052433,0.2459515,0.71582323,0.8959969,0.64107907,-0.8613097,0.30564898,-0.44838157,0.05994665,0.37130746,-0.6602124,-0.55048656,-0.35078096,-0.3051152,-0.19579309,0.765252,0.77342695,-0.3066374,-0.24239235,0.445441,-0.08277681,0.9718003,0.20901714,-0.9938765,-0.3034178,0.99337906,0.31754005,-0.42882165,-0.95868784,-0.30108342,0.80745935,0.5618136,-0.060497195,-0.6661453,-0.13697346,-0.13770486,0.72229683,-0.020891748,-0.28337616,-0.3428852,0.08096941,-0.043691218,-0.15487492,-0.9996738,-0.9994308,-0.99672705,-0.2648217,-0.2548809,0.49770376,-0.10240946,-0.72362274,-0.74046487,0.4972769,0.031731814,-0.31452835,-0.85736847,-0.25972846,0.320814,-0.63932765,0.56861544,0.2409353,-0.38348705,-0.99223393,-0.9997093,-0.6865212,-0.3121523,0.29751843,-0.6184785,0.07310824,-0.90102506,-0.10801638,-0.012927903,-0.08441483,0.1995274,0.19018994,-0.42764655,0.9188047,-0.00673338,0.8088863,-0.16127469,0.56068045,0.32545835,-0.8411953,-0.29835832,0.068095714,-0.15360591,0.8194869,0.10744155,0.19497491,-0.33322743,0.25329924,-0.50269014,-0.51007414,0.07370161,0.5992252,0.29480293,0.30833846,0.24274503,-0.9784315,0.09774713,-0.58381665,0.37582895,-0.60113424,0.16880742,0.99918526,0.15154879,0.08692527,-0.37183663,0.7766553,0.5803021,-0.3636745,0.91050744,0.07263066,-0.69474566,-0.09325983,0.5370003,0.0412246],
    [226,1,"O=c1[nH]c(O)cn1N=Cc1ccc([N+](=O)[O-])o1",0.6159442,-0.50383097,-0.46644548,-0.6365618,-0.23487468,-0.12866548,-0.65864253,0.732324,-0.3646046,0.3041426,0.72836006,0.5314502,-0.3722348,0.15450141,-0.2802367,0.09238713,0.35221675,0.4930638,-0.6051757,0.6716869,0.7380188,-0.19594686,0.107473366,0.8962762,-0.7080238,-0.25817928,0.8796291,0.05144344,-0.34100878,0.28188023,-0.05758029,-0.31410757,-0.2708662,-0.25390056,0.60324144,0.19733256,0.2943004,-0.3568372,0.9794149,-0.11890919,-0.817521,0.23421709,-0.10819022,0.4202402,-0.14558484,-0.9190091,0.6783732,0.15925819,0.82795477,0.042126942,0.29683456,0.27066988,-0.25654128,-0.6537827,-0.07969728,0.61132544,-0.7649341,0.5567534,-0.19626921,0.6967921,0.6348029,0.6299872,-0.45980144,-0.29420212,-0.71208656,-0.12012239,0.44512728,-0.450157,0.22150953,0.09946805,-0.9504125,-0.9997396,-0.1258522,-0.6041124,-0.5998376,0.12723534,0.5986253,0.34708717,-0.17231403,-0.99751925,-0.4954962,-0.44021526,-0.9138252,-0.7229198,0.3073032,0.80431867,-0.002723438,-0.24067426,-0.88637483,0.14352165,0.21738154,0.21768813,0.18759485,-0.020166395,0.9999691,0.043247275,-0.90203434,0.29301405,-0.23655203,0.3993141,-0.739526,-0.1114976,-0.24390538,0.92088866,-0.72376156,-0.9551976,0.074403904,-0.097788095,-0.99996924,-0.21548972,-0.132403,-0.4436401,-0.23932934,0.41085556,0.55003434,0.24934468,0.20946594,-0.257259,0.99886185,-0.5677096,-0.22769022,-0.30187944,-0.38104224,-0.41699612,-0.648627,-0.5155075,0.18996193,-0.10741752,0.38672736,0.764244,-0.03860186,-0.7635449,-0.19559003,-0.24271639,-0.05813474,-0.5028352,-0.4546438,-0.35435048,0.2785194,-0.8053267,-0.99999654,-0.28908664,-0.1146283,0.33783546,0.32985672,-0.5566248,-0.37112767,-0.3997388,0.1573358,-0.6097497,0.6350559,0.30443877,-0.5941659,-0.6336717,0.41228813,-0.72415257,0.7198223,0.9618052,-0.2278402,-0.38843077,-0.97132605,-0.6950713,0.3016882,0.2056707,-0.41553205,-0.13813706,-0.013271832,-0.3037106,-0.15710603,-0.53435767,0.5340398,0.13737285,0.15930974,-0.80128485,0.617669,0.52336556,-0.6576358,0.2271343,-0.003065953,-0.603304,0.19073391,-0.999406,0.27820596,0.16041465,0.25833324,-0.41899094,-0.29136267,0.48337218,-0.42196554,0.16258395,0.25538415,0.3248984,0.470789,-0.78810513,-0.3210278,-0.42513865,0.74730885,0.8770509,-0.017291607,0.23057196,0.14605604,-0.16604628,-0.51015747,0.6112799,-0.08602139,-0.8475068,-0.22422998,-0.0751577,0.005117814,-0.9988537,0.107021526,0.039552417,-0.08946256,0.39176524,0.26091576,0.84361154,0.6200912,-0.14924444,-0.6060034,0.17357062,-0.5425246,-0.5183641,0.6229314,0.8226785,0.99759924,-0.17902605,-0.5720579,0.82276666,-0.09158014,0.17049745,-0.42375544,0.20163728,-0.4298812,0.14729951,-0.3775868,-0.081480086,-0.001270541,-0.4112841,0.50489163,0.4932316,-0.94189024,0.4900709,0.084249824,-0.39468682,-0.07853161,0.5514007,0.15245616,0.6200237,-0.8153551,-0.09011484,0.07348173,-0.9605425,-0.3874127,0.50270385,0.2832569,-0.29406896,0.44449568,-0.114746034,-0.30256188,0.4798012,-0.14570418,0.23495033,0.39394844,0.4940528,0.72030836,-0.026860693,0.1853914,0.76677626,0.6199948,-0.5923542,0.2617904,0.99816513,0.4714017,0.32058114,0.23453604,0.8774934,0.18860933,0.4970165,-0.6372299,0.15108511,0.4864972,0.999439,0.12464341,0.44726276,-0.2711786,-0.17720747,-0.15511516,-0.8467178,-0.8659626,0.582534,-0.054167762,0.9975053,0.002618035,-0.115446284,0.40457562,0.79334533,0.9999979,0.38271394,-0.12344966,0.4102022,-0.07947144,0.84730625,-0.6282322,0.66867095,0.5880061,0.7020471,0.5038488,0.6102251,0.649353,-0.003594284,0.28604376,-0.50598776,0.27417028,-0.24335392,-0.9162923,0.15623993,0.2822928,0.3941063,0.97115386,0.63288516,0.63658786,-0.45125315,0.81769454,-0.40163395,0.08448575,-0.34284458,-0.2747152,0.09693015,0.003079801,-0.49210507,0.5902792,-0.3546162,-0.8656394,0.4555833,0.19536738,-0.9810338,0.15839836,0.09907091,-0.71828115,-0.32323098,0.34553787,0.2720426,-0.7524517,0.38866425,0.10810335,-0.017533889,0.41898668,-0.53300345,-0.31863907,0.13965409,-0.97503114,-0.37878442,0.014015138,0.012329519,-0.14658587,0.7028512,0.24630824,0.9997976,0.2612037,0.76635575,0.4881018,0.5337432,0.72002447,0.87881863,0.29653132,-0.06007165,-0.37021405,-0.012986674,-0.07276148,-0.23899439,-0.0637527,0.5582884,0.013964567,-0.2890551,-0.18693388,0.99315757,-0.471426,0.28092214,0.3837015,0.20813084,-0.2003312,-0.15944785,0.007690806,0.16143626,0.59343404,-0.07696708,0.69117314,-0.4422315,0.027858187,0.44792247,-0.7254702,-0.4860296,-0.65629554,0.43056577,-0.05358923,-0.5635941,0.45002836,0.7316474,-0.046340328,0.6632158,0.97868055,0.34466088,0.3105297,-0.02972947,-0.000689307,0.7010865,-0.1016234,0.9802813,0.2287587,-0.121854745,0.5873745,-0.30777547,-0.28261948,0.22222435,0.2061054,-0.4106838,0.93353087,0.14076433,-0.9661197,0.14278829,0.99910474,0.04174204,-0.4388351,-0.951492,-0.72745,-0.22472289,-0.122473665,-0.5589291,-0.80165356,-0.58967954,-0.6153629,0.95136935,0.29750624,-0.78595555,-0.524264,-0.14281522,-0.3198554,0.12434019,-0.999986,0.99692726,-0.9399817,0.5796696,-0.21307667,0.68066996,-0.31276962,0.3154713,-0.7717599,-0.6395139,-0.08021586,-0.12712127,0.3758381,0.2907568,-0.33978626,0.6230821,0.102861345,0.41994187,0.3264074,-0.8674251,-0.99996656,-0.09394831,-0.6820994,0.116002224,-0.49674982,-0.5104866,0.91908956,0.46728218,-0.0845143,-0.5612292,0.19866994,0.000182733,-0.5214068,0.9447588,0.68375427,0.6718893,-0.021917816,-0.24456514,-0.23931886,0.40285,-0.36996686,-0.24651834,-0.298757,0.969925,-0.9148608,-0.17212331,-0.5556719,0.39314777,0.5367162,-0.27305308,0.00949256,0.4946469,-0.6717265,0.3672024,-0.40782195,0.800414,0.7077265,0.31922463,-0.8259429,0.3975455,-0.51608586,0.9996254,-0.41432574,0.42236516,-0.69910467,0.2213911,0.09308023,-0.16275541,-0.9738089,0.612818,0.4366111,-0.8766141,-0.55568784,9.13e-05],
    [227,0,"N=c1c(Cl)c(F)[nH]c(OCC(=O)O)c1Cl",-0.078293934,0.38101754,-0.86186254,-0.6941625,-0.23299046,0.0687876,0.6556071,-0.70718974,0.38946962,0.23594466,-0.4836149,-0.19452374,-0.13293342,0.05661348,0.10285002,-0.7088631,-0.25529522,-0.32778838,-0.5229818,-0.7383111,0.49497223,-0.40134746,0.19530617,0.12219412,0.35098737,0.4350415,-0.08655825,-0.47007662,0.68276566,0.10038724,-0.17674154,0.09359009,-0.553177,-0.53211975,0.2637834,-0.41705534,-0.19304042,-0.6041042,0.9300331,-0.48052838,-0.27381638,-0.33555907,0.6317346,-0.066730276,0.12457592,-0.9747012,0.53748757,0.1694854,0.5768126,0.59574753,-0.02749988,0.37107748,0.18504387,-0.5205043,-0.31958747,-0.81381917,-0.31633875,0.6960458,-0.5772181,-0.06831578,0.64570606,-0.09496696,0.1410856,0.2932346,-0.6132285,-0.2773861,0.75109273,-0.06051027,0.68256503,0.055231497,-0.93751633,-0.99420446,-0.18087019,-0.25046453,0.054631937,-0.1048014,0.06678304,-0.56492436,0.47235164,-0.99846,-0.8650092,-0.79695016,-0.9149728,-0.48353052,0.3459502,0.6127431,0.63749754,0.60315794,0.3843587,0.5802594,0.39837852,0.2893124,0.46313703,0.4394007,0.99741316,-0.089011334,-0.53520936,0.51377255,0.5388963,-0.21655999,0.22103602,-0.6755325,-0.20691784,-0.025890779,-0.21876572,-0.7682793,-0.45582083,-0.39253896,-0.9999784,-0.102969654,-0.3023122,-0.32012966,-0.42890096,-0.31234488,-0.07567676,0.13356563,0.40292555,0.5976634,0.9995777,-0.26549885,0.35560086,-0.082445,0.30057558,-0.18932155,-0.27264807,-0.19345124,-0.3606637,0.5961555,0.13974622,0.98142606,-0.5072269,-0.61919534,0.6216091,-0.35986927,0.30256107,-0.7161062,0.07576908,-0.3097135,-0.70792454,-0.1622754,-0.9990844,-0.054875743,0.90847164,-0.21338122,0.064927414,0.70956993,0.27767408,0.22916466,0.8593256,-0.18450908,0.5339534,-0.44663152,0.3785698,0.63818216,-0.16833694,-0.39459717,0.2854079,0.9925953,-0.33193225,-0.29135513,-0.98582786,-0.3381077,-0.25404698,0.676794,0.66902107,-0.019288253,-0.00602504,-0.43412966,0.05094962,-0.2847714,-0.79984766,-0.57105434,0.2128206,0.46898603,0.29537708,0.41295892,-0.42440805,0.034472045,0.2668511,0.46090925,0.39537194,-0.9805679,-0.15657747,-0.02146068,0.17942594,-0.2999207,0.2987924,-0.037861962,-0.019088186,0.04946667,0.94106627,0.4010173,0.42982915,-0.24999079,0.23419002,-0.021306874,0.40634188,0.6279536,-0.46339893,0.12602851,0.13536967,0.78133947,-0.28536242,-0.5665616,-0.37776506,-0.14095105,0.20429085,0.65535575,-0.07523287,-0.99443674,0.48056418,0.45211715,0.082336456,0.32236522,0.38005698,0.4650563,0.4718791,0.308517,0.040522024,0.57879066,0.038020838,-0.22196247,0.049506973,0.54700845,0.99961656,0.00303668,-0.33677766,0.63526326,0.22786248,-0.17567766,0.009716657,0.17737807,-0.2368964,0.008950866,-0.013165406,-0.5479327,0.117912665,0.020311458,-0.019117793,0.50911695,-0.9731314,0.30604178,-0.05287343,-0.36794996,-0.042532247,-0.10146075,0.22414349,0.19328393,-0.7571865,-0.36522,0.1497821,-0.9986068,-0.1770632,-0.33920547,-0.16195938,0.4244145,0.7997518,0.5911422,-0.6516004,0.64334804,-0.5996548,0.21464667,0.23756531,-0.21865745,0.79899263,-0.22005638,-0.5320928,0.3577355,-0.1315434,-0.110261515,-0.26881242,0.9962608,0.5767311,0.29341102,0.77497894,0.9006833,0.14250875,0.24945821,0.30188525,-0.47574344,-0.13041933,0.99936944,-0.13592015,-0.043034147,0.58812445,-0.4767673,-0.72219616,-0.9331082,-0.8665799,0.061572347,-0.13120158,0.9988292,0.51170886,0.760323,-0.679094,0.10156243,0.99899226,-0.66927344,0.34656832,0.6665436,0.20155036,-0.47834086,-0.13373384,0.6528926,0.75278217,-0.6048504,0.9252789,0.47630623,-0.5480901,0.17348887,0.736235,-0.1869738,-0.07297128,-0.34035596,-0.3748549,-0.08714014,-0.40294924,0.3757882,0.9990479,0.18824185,-0.008600953,0.5958032,0.75350994,0.119052775,-0.3559321,0.09802919,0.19825187,-0.74854577,0.1866946,-0.11772331,-0.1610365,-0.053142536,-0.15629506,0.5870655,0.6469791,-0.79222405,0.4868765,-0.05227244,-0.13922851,0.4787342,0.11578767,-0.35088062,-0.6027535,-0.46042818,0.4498674,0.5199602,0.59076214,-0.16482612,0.38868752,0.57297146,-0.98397547,-0.2667491,0.33847985,0.17656678,0.20742787,0.70944273,0.121854186,0.9995609,-0.7751054,0.82275516,-0.6046184,0.48467863,0.36422068,-0.06910245,-0.18024956,-0.5920969,0.30864263,0.8560573,0.07869134,0.52340037,0.28018546,0.6231318,0.5037518,-0.30209148,-0.006761835,1,-0.6266604,-0.2509875,-0.23868637,-0.6275786,-0.8320608,-0.7741846,-0.6438717,0.18235537,-0.18284748,0.059017193,-0.36592185,0.35558763,-0.49971062,0.7883065,0.41031978,0.60444736,-0.6776126,0.53759825,0.7860413,-0.8502022,0.12599415,0.6498365,0.59337294,0.6352695,0.10824094,-0.088747725,0.5338111,0.39155263,-0.037994575,0.5871835,-0.053517334,-0.68301475,0.38113186,0.39598823,-0.22722459,0.40555507,-0.28881213,-0.017287869,0.6886842,0.32217914,-0.33223048,0.6773494,-0.9951799,0.6289335,0.99960226,-0.75384456,0.16632248,-0.8530041,-0.619655,0.531474,-0.080658376,0.23750032,0.28305826,0.07327867,0.18964641,0.31481373,0.53491426,-0.40051535,-0.21103187,-0.08480284,0.37274674,0.7510275,-0.9999926,-0.99793404,-0.9898729,0.2903092,-0.7008814,-0.21253921,0.001348051,-0.48489577,-0.7130187,-0.048975006,-0.049404,-0.20811443,-0.5134035,0.62226444,-0.6994489,0.61615306,0.7175723,-0.5885169,-0.23995343,-0.9281426,-0.99995446,-0.1497569,0.020490935,-0.17294033,0.021307632,0.43242976,-0.13876347,0.3127589,0.002464833,-5.71e-05,0.18510656,-0.3351675,-0.47710487,0.93931144,0.67415476,0.80587,-0.7666107,-0.5950989,-0.29564595,-0.6802661,-0.64675844,0.07583563,0.47543785,0.74321884,-0.9597206,0.225126,-0.24812269,-0.70766866,-0.4452354,0.79815,0.2783564,0.82952774,0.5807846,0.45627546,0.15839589,0.29110155,-0.5601112,-0.02382245,-0.6858658,0.016183633,0.24276507,0.9998412,0.53000665,-0.66477853,-0.25880817,-0.017302226,-0.000362681,0.15644038,-0.92563534,-0.5246285,0.71258897,0.5218821,0.26523775,-0.2840321],
    [228,1,"CCCCC(O)(Cn1cncn1)c1ccc(Cl)cc1Cl",-0.48518172,-0.2720951,0.4611914,-0.16186638,-0.055923697,-0.19027348,-0.6542631,-0.33790207,-0.10176342,-0.3444223,-0.40805826,0.010899305,0.015799899,-0.7118461,0.02729978,-0.11686071,0.7667331,-0.40337053,-0.6489369,-0.06867251,0.2805709,-0.2630592,-0.61375207,-0.13030596,-0.2096231,0.09059173,0.45516807,0.10958821,0.2783326,-0.22922577,0.40842447,-0.24342437,0.69364905,0.5574521,-0.2901177,-0.20535745,0.607942,-0.027659807,0.9922629,-0.7860487,-0.68172055,0.55821425,-0.14807768,0.14545776,-0.43705553,-0.8757383,0.1032593,0.33017376,0.60739964,0.29449007,0.7055672,0.21063884,0.03171322,-0.040498447,-0.8008048,0.15943342,0.020369986,0.37753928,0.64422977,0.23583762,-0.074280895,0.4762421,-0.24859154,0.2692719,-0.2683289,0.15516317,0.06543496,0.6770167,0.44543126,-0.4800136,-0.8720049,-0.90089333,0.44000733,-0.10823958,0.7203301,-0.27497134,0.26610819,0.56517935,-0.67927545,-0.9981748,0.1123917,0.32079425,-0.93264574,0.61866957,0.22576387,-0.83777916,0.2335903,-0.25198904,-0.16218196,0.38073334,0.10622178,0.46227342,0.44666246,-0.32135952,0.9926171,-0.2613348,0.56491125,-0.50211155,-0.001731934,-0.1396827,0.2523495,-0.22994581,0.16859148,0.8668709,-0.8890164,-0.8359438,-0.21078585,0.22868758,-0.83121026,-0.15954413,0.6745399,0.040049527,-0.6282236,0.07264084,-0.50786,0.58750015,-0.611499,-0.07239304,0.9956498,-0.23479953,-0.81656265,-0.2812212,-0.27211857,-0.095645115,-0.5363196,-0.21702889,0.3965021,-0.36622897,-0.4255641,0.9997287,0.6560014,0.2413268,0.24634463,0.2611959,0.14204496,-0.94864297,-0.11113815,0.41059738,0.1099863,-0.6727274,-0.999863,-0.5784871,0.93195325,0.20354669,0.43829647,0.12058853,0.36046085,-0.19429179,0.07216946,-0.18013138,-0.19108318,-0.8464258,0.13029958,0.006227368,-0.19538604,0.39070776,0.6140482,0.89767236,-0.6211817,-0.38409188,-0.9392841,-0.631009,-0.46399197,-0.86272764,0.39445677,0.62253296,-0.22556615,-0.13873543,0.2245924,-0.026336579,0.10971783,0.499218,-0.57542616,0.12539034,0.2578204,-0.48944813,-0.5468047,0.49406695,-0.6045791,0.4965138,0.31338897,-0.52166396,0.34259957,-0.31204468,0.028969938,-0.09525486,-0.008099743,0.5524161,-0.68745947,-0.39288425,-0.55240446,-0.6931877,-0.37733,0.19161457,-0.054019347,0.10224614,0.74923897,-0.5069205,0.11046926,0.7603063,-0.45439485,-0.57139343,0.10897924,-0.16301046,0.21185479,0.014782568,0.20869464,-0.34417814,-0.3755058,-0.99971277,-0.1550139,0.19446047,-0.23860447,-0.19135019,0.1275784,0.24731575,-0.14510413,0.28493595,-0.15867376,0.08719711,0.32080522,0.077198386,0.57320285,-0.28276893,0.9817104,0.1320154,-0.03763347,0.72608984,0.00435001,0.22522718,0.05896414,-0.74875927,0.51244086,0.009639019,0.74203944,-0.18830024,0.61287403,-0.8700117,-0.3707176,-0.7267208,0.931126,0.0836778,0.057855096,-0.4576949,0.37662184,-0.43230632,-0.4756893,0.09325532,0.099468045,0.7111973,-0.39787564,-0.9706362,0.09198529,-0.044985153,-0.4736949,-0.7149448,0.5468626,0.05933219,0.28765765,-0.23926735,-0.33883798,0.14462943,-0.17857751,-0.21917997,0.32719037,-0.026941536,0.25447315,0.2929403,0.3300904,-0.4749716,-0.113098696,0.98499846,-0.513722,0.3743523,-0.48906115,-0.2962128,0.06871797,-0.60386276,0.37186694,0.04908009,0.67671293,0.9985311,0.18759207,0.25125447,-0.4104844,0.5769524,0.337312,0.67088836,0.06217558,-0.20124663,-0.33630523,0.9902129,-0.023204945,0.7101022,0.03234856,-0.73599,0.9999758,-0.98332775,-0.45142996,0.52136695,0.18896133,0.62158996,-0.41252688,0.3475224,0.7949479,-0.2824821,-0.48765454,0.22250587,0.3447279,0.24411453,-0.33484215,-0.15576275,0.01961532,0.030293144,0.6203599,-0.4368965,0.22471017,0.04984398,-0.9395822,-0.16632009,-0.36409912,0.14845477,0.46742234,-0.71492296,-0.07162094,-0.43695128,0.54150134,-0.74498606,0.6881626,-0.184652,-0.57853276,-0.18953453,0.069232754,0.24081749,0.42914778,0.4083305,0.24614157,0.8937481,0.33562154,0.097276196,-0.43951976,-0.6445956,0.7002076,0.6351208,0.6608405,-0.1894846,-0.83212215,0.62025315,-0.75661993,-0.18833165,-0.97524494,-0.5793755,0.7449132,-0.16668193,0.47147802,0.6384652,0.60153717,0.9998665,-0.4413039,0.18117572,-0.1419084,0.10529819,0.09557699,0.7319355,-0.6686426,-0.10611521,0.64828855,-0.38343158,0.12526014,-0.5897488,-0.12543768,0.18354204,-0.05914961,-0.2599512,0.36014622,0.9952408,0.102099955,0.044454824,0.14895234,0.7501439,0.34476352,0.2410407,-0.27544442,-0.08887376,0.16220039,0.29998097,-0.39300257,0.7199669,-0.30402854,0.50545996,-0.26809385,0.57039696,-0.23309797,0.009497236,0.24258095,-0.6637576,-0.26969108,-0.65242946,0.40614456,-0.31410685,-0.075494304,0.39331552,0.09514703,0.3795948,0.22768542,-0.009264705,-0.67307514,0.22382285,0.07619558,0.5216349,0.07572839,0.36475018,0.60235256,0.2611286,0.64044255,0.16725148,0.999917,-0.60259444,-0.95937854,-0.34899673,0.9990192,-0.7027807,0.026683237,-0.9982887,0.14580564,0.08018762,0.22441015,-0.47669744,0.15205093,0.41203666,0.10726012,-0.2177753,0.026667532,0.09589622,-0.512329,-0.54362243,-0.22738339,-0.24579237,-0.99995404,0.9967281,-0.8028091,-0.59151924,0.5534251,-0.35265753,0.7691882,-0.4335374,-0.36835867,-0.065047786,-0.1755326,0.5913478,-0.4166829,-0.023976604,-0.54530823,-0.03740435,-0.03251394,0.39698777,-0.48732907,-0.23750278,-0.9997756,0.5878178,-0.7208868,-0.1576054,0.37009448,0.15883835,-0.8998615,-0.34435695,-0.7146223,0.2371211,0.18773203,-0.06696694,0.3687962,0.96478194,0.29080936,0.089093186,-0.152709,0.24190731,-0.15477245,-0.37534097,-0.46359256,-0.771256,-0.3633707,-0.21400662,0.08685595,0.10256443,-0.05579339,0.14526363,0.7112435,-0.4545656,0.10094202,0.3710205,-0.75446063,0.42258084,0.21317889,0.96785384,-0.09534192,-0.16811006,-0.3075567,0.2575432,0.47910956,0.99986345,0.67428017,0.076725006,0.13952173,0.4643902,0.4686945,0.4949916,-0.9843249,-0.5314279,0.31938216,0.36767873,-0.08883962,0.42607448],
    [229,1,"CCNP(=S)(OC)OC(C)=CC(=O)OC(C)C",0.9090409,0.19201605,-0.86437964,-0.23003124,0.47961012,0.10632005,-0.92558897,0.1681994,-0.35141215,0.44922346,-0.37298223,-0.17905779,-0.4516762,0.2184569,0.24756221,-0.78366613,-0.73251414,-0.15840724,-0.72919863,0.2297352,0.07390639,-0.4087585,-0.29502007,0.016479082,-0.40718746,0.5367458,-0.46696585,0.43016803,0.031780545,0.54871064,-0.37255478,-0.6021539,-0.31332698,-0.68411404,0.68012583,-0.122967824,-0.33976683,0.18144667,0.99033827,-0.1744016,-0.8947314,0.007364994,-0.25943694,0.030092997,0.31753534,-0.8979758,-0.21284135,-0.23397638,0.9791567,0.24833775,0.54621303,-0.44047597,0.19052006,0.6244824,-0.4211375,0.26542106,-0.3139748,0.29089218,-0.23429531,0.4029251,0.05094912,0.5800248,-0.27482685,-0.21462572,-0.7480524,0.27544308,0.45345247,-0.36203337,-0.28525952,-0.29631162,-0.7002515,-0.98950183,0.3759676,0.80100584,0.114160284,-0.8349832,-0.40659797,-0.37702304,0.23450089,-0.9999203,0.48351547,0.11528019,-0.63254124,-0.66191745,0.79310024,0.16264725,-0.6034597,-0.46183512,0.10387832,-0.1033055,0.76603526,0.34199214,-0.2824273,-0.3894151,0.9988757,0.6908151,-0.34420195,0.11919584,-0.15026626,0.3235218,-0.014662543,0.5953824,-0.15431927,-0.12718232,-0.8473608,-0.82594794,-0.3331102,0.03732458,-0.91381824,0.2592381,0.6097351,-0.38053647,-0.6592852,-0.42172247,0.7407773,0.3243323,-0.301465,0.21385778,0.9983735,-0.30633146,-0.46991062,0.22935519,0.6621263,0.44215712,-0.48173442,0.14363275,0.049297355,0.4719536,-0.45042697,0.9959325,-0.37164947,-0.39000598,-0.16281013,-0.04244417,0.26735157,-0.9933891,-0.11690115,-0.010893237,-0.53063446,0.11471082,0.99353933,-0.13800126,0.8305331,-0.4334335,-0.32182035,-0.23209468,-0.33780283,0.2280075,-0.14447367,0.09942003,0.8739771,-0.5870289,-0.29316497,-0.601526,-0.27866137,-0.025343345,0.16220403,0.9549329,-0.76799226,0.16648494,-0.93978584,-0.5986648,-0.38712612,0.73723054,-0.15644336,-0.17029606,-0.28834185,0.07725767,-0.009529289,-0.3874524,0.057378214,-0.56514126,0.5255967,0.11209795,-0.15354234,-0.7390784,-0.40296775,0.7561235,-0.47492802,0.28399327,-0.07051238,-0.98448443,0.050814565,0.6073227,0.5003529,-0.120855756,0.44665876,-0.42061883,-0.07766202,-0.3674234,-0.16562791,0.08411996,-0.46469846,0.26644298,-0.45543343,-0.05171194,-0.052342266,-0.9294283,-0.047502745,0.08073915,0.51500016,0.028990842,-0.06657099,-0.23360634,-0.65436107,-0.07390786,-0.06430774,-0.14299868,0.17267977,-0.9998633,-0.5802245,0.003181559,-0.118606776,0.56665134,0.64292705,0.27539256,-0.7157774,0.5107621,-0.5654278,0.7774416,-0.003632315,-0.37982944,-0.15665838,0.1444165,-0.9847006,0.016851729,0.16557615,-0.5695058,0.39952117,0.5570178,-0.58033085,0.03740222,-0.55505365,-0.031306207,0.25217187,0.052386772,0.11912943,0.28512675,0.19744648,-0.613825,0.65323,0.4197741,-0.27281788,-0.24470031,-0.77686393,-0.67347634,0.24300449,-0.28296003,-0.073392816,0.15571918,0.60108685,-0.99985236,-0.25609252,-0.05955755,-0.5248761,-0.363571,0.36585265,-0.111257896,-0.16725199,-0.42200953,-0.42684135,-0.1354292,-0.07488454,0.7403984,-0.385253,0.007545115,-0.42302564,0.5447957,-0.013273193,0.3173121,0.396482,0.9995275,0.41385752,0.6444483,0.948281,-0.9578316,0.68320394,0.435961,0.45373854,0.265256,0.41742334,0.99859303,-0.7439916,-0.46203643,-0.14760537,-0.25624302,-0.3126506,0.20477217,-0.95169216,-0.79478,-0.39873543,0.99553996,0.42377853,0.6648956,0.15274347,-0.3761249,-0.9854488,-0.86182046,0.62576056,0.28840104,0.13352892,0.6696345,-0.33501178,-0.38591725,-0.14190961,0.3569202,0.564531,0.59610164,0.06687863,-0.28707874,0.3686096,0.7948733,-0.6239705,-0.8063576,-0.37936422,0.5091833,-0.32038435,0.7746235,-0.9067234,0.21204321,0.21319458,-0.5474333,0.00537473,-0.6731956,0.7512786,0.2154407,-0.33448938,-0.36460862,0.34528226,0.096053794,0.07829509,0.33837885,0.620749,0.62739146,-0.5060123,-0.52537817,-0.275138,-0.5681248,-0.4127226,0.12310401,0.19297394,0.35251388,-0.7132466,0.18247259,0.02421103,0.5165393,0.6937054,0.43814018,0.14476742,0.08977279,-0.96245146,0.27756602,0.19052722,0.25180537,-0.44787794,-0.334236,0.48126268,0.9999582,-0.0905442,0.30261928,0.39272895,0.1404397,0.44994727,0.18012871,-0.38366008,-0.5650644,-0.25299704,0.7896463,0.3821306,0.23354977,0.32002085,0.62992495,-0.053439163,0.19012758,-0.1540531,1,-0.27355498,0.8034126,-0.19744472,0.09433474,-0.6813345,0.62683475,0.04738799,0.6907792,-0.07882062,-0.09796656,-0.31075943,-0.29272985,0.13206771,0.45363757,-0.25043604,-0.2652405,-0.617549,-0.024426837,-0.38278335,-0.9877596,-0.32680243,-0.47777465,-0.23892641,-0.023580177,0.58041036,0.02303359,0.14327827,0.13178208,0.13703176,-0.1512902,-0.3167535,0.12831314,0.3613511,-0.7549335,-0.6266939,0.21304612,0.52118254,0.39690578,-0.04965577,0.22233555,0.9999153,-0.17818066,-0.81570023,-0.60570693,0.9994685,0.61487645,-0.38053337,-0.998941,0.42994818,-0.48399404,-0.08480285,-0.40402535,0.048781984,-0.08770302,-0.7044726,0.5869239,-0.3985763,-0.33832887,-0.6621707,-0.11846158,0.20169584,0.8098477,-0.99995404,-0.99999994,-0.97020304,-0.47695065,0.76018596,-0.5085374,-0.51078826,0.19069566,-0.2911189,0.1754735,0.6808302,0.049071766,-0.2564199,-0.5121666,0.11672035,-0.5002322,0.71599644,-0.07300852,-0.07594615,-0.7105736,-0.9998404,0.45958143,0.33287403,0.7063266,0.08688267,-0.009879253,-0.3304483,0.36401752,0.70053154,0.65978235,0.897041,-0.7647078,0.28533712,-0.8150581,0.53981936,0.051150367,-0.58971214,-0.2625046,0.18798809,0.4123328,0.28563964,0.40676707,-0.35872564,0.7643119,-0.9879048,-0.09732565,-0.3479679,-0.31990194,-0.16523966,-0.17572139,-0.20641294,0.6764404,0.386566,0.6814418,0.4005248,0.87544346,-0.64039046,0.45178047,0.12600316,0.3853858,-0.5312219,0.9999261,0.4935232,-0.0802662,0.14765213,0.43330622,-0.42096305,-0.20136453,-0.98989135,0.007332439,-0.11133829,-0.030844538,-0.14199363,0.5408267],
    [230,1,"CCCCCCCC1CCC(=O)O1",0.35730305,0.14819087,-0.6507372,0.086164854,-0.016399529,0.03277047,0.06406852,-0.18198487,0.59537685,0.17655298,-0.09015923,0.078886546,-0.21173193,-0.62205577,0.58779967,0.25662273,0.77176744,-0.22885385,-0.12775473,-0.5712583,0.559409,-0.7326225,-0.50938576,0.6307418,0.19664429,-0.35841998,-0.07542927,-0.12500097,-0.052600402,-0.19112076,0.044609237,0.602329,0.75547457,-0.22632158,0.5097106,-0.70240235,0.3593161,0.20949204,-0.13033728,-0.733649,-0.9880987,-0.2085068,-0.35796013,0.3664812,-0.020136144,-0.99356586,-0.10775053,-0.3373175,0.99319726,-0.4141047,0.67319685,0.59038883,0.2301705,0.4075569,-0.836425,0.18375202,0.8604077,0.9778483,0.33237618,0.09413464,-0.30522212,-0.7278361,-0.25954592,0.31243023,0.22380571,-0.1667445,-0.5403667,-0.17119783,0.6826661,-0.38389823,0.8936107,-0.94020677,-0.46083355,0.8195508,0.49990496,0.70531267,-0.2736636,0.24607167,0.040093977,-0.99993753,-0.44440377,0.025506692,-0.5926724,-0.4826439,0.3536263,0.006631161,-0.038326506,0.21005137,-0.18969668,-0.7175532,0.019733826,0.18575622,0.7879947,-0.123677,0.93678063,-0.5304126,0.67582434,0.31785142,0.28735477,-0.2669311,-0.004762243,0.004240766,0.32644227,0.7459348,0.89784044,-0.13875723,0.5791953,-0.4240709,0.94834125,0.6118279,0.066073276,0.61678356,0.6453175,-0.20664182,0.5041281,0.14827755,-0.08804017,-0.26355258,0.99826753,0.33544195,0.298734,0.38728914,0.1930322,-0.16845706,-0.28008798,-0.43626517,-0.35852575,0.042156942,0.35423487,0.99955916,-0.03904099,0.13201033,-0.3261092,0.17527199,-0.5171839,-0.9360435,-0.34989375,0.28099024,0.13725357,0.03546441,-0.9982094,-0.19278753,0.98135436,0.0731902,-0.2904023,0.28813508,-0.031760555,0.1913048,0.9845113,0.34647292,-0.18259917,-0.82367593,0.6730488,0.19599126,0.15309784,0.11524367,0.13198584,0.9981908,0.36847273,-0.9549427,-0.9879804,-0.2032247,0.4796516,0.35366035,0.5824844,-0.32139784,-0.4359282,-0.66390085,-0.35442895,0.18762274,0.017945925,0.23388112,0.049980476,-0.41303843,0.5113165,-0.97686005,0.56525135,0.5426523,-0.5703233,-0.10394562,-0.50299317,-0.67536,0.49605644,0.33420813,-0.87429106,-0.07584403,-0.27611485,0.56124425,-0.12942864,0.7517177,-0.6695407,0.16187277,-0.09021825,0.36983085,-0.29168987,-0.35817036,0.054648932,-0.7808857,0.31870767,0.0733847,-0.120706625,-0.37236556,0.017040754,0.40112,0.36158976,-0.63929254,-0.11011421,-0.68301344,-0.22320394,-0.9599481,-0.3934945,0.39407748,-0.18580051,-0.8562962,0.19738442,-0.09847013,-0.20413326,0.69256115,0.28725603,-0.033191442,0.111761615,-0.16348359,-0.13156953,-0.64318323,-0.89211494,0.69935834,-0.20387246,0.030251978,-0.33622548,-0.27564302,-0.00261115,-0.19210583,0.38541636,0.04108111,-0.5088225,-0.13612375,-0.5058136,-0.34435543,0.07134142,0.17511591,0.80961967,-0.38097498,-0.065380074,0.0668939,-0.7929914,0.29725945,-0.23665965,0.30665553,0.21393786,0.24285802,0.117666855,-0.9977943,0.00592189,0.6709728,-0.23903435,0.31729817,-0.09359963,-0.049882367,0.0509149,-0.23911776,0.31303382,0.11377697,-0.54409707,-0.8346063,0.10864613,0.3280104,0.7489423,-0.42121166,0.5797483,0.33804184,-0.6812383,0.21870382,-0.14151889,0.26134244,-0.13806729,-0.16521612,-0.13595448,-0.4906151,0.2735023,0.8034698,-0.200978,0.99942136,-0.41347277,0.66593736,0.042430736,-0.015872994,0.49227417,0.6922337,0.83390903,0.071766436,-0.34004378,0.999256,-0.3478094,0.07534548,-0.008424956,0.7196915,0.99964374,-0.9837195,0.3800385,-0.29222652,-0.4404175,0.06288422,0.52391803,0.44255066,-0.1724146,-0.7453439,0.9879995,0.16647142,-0.12041197,0.57415867,0.44733936,0.33981353,-0.18907727,-0.34391233,0.552565,0.11423,0.23923121,0.0683772,-0.9998641,-0.42405996,-0.57174504,-0.21396327,0.10394151,-0.7837566,0.232072,-0.26458976,-0.12843424,-0.8677873,0.15249065,0.3505647,0.1168858,-0.0741086,-0.024139442,-0.049341097,-0.49035865,0.54882133,0.36867595,0.37409797,0.73012996,0.0785274,-0.03206347,0.31352645,0.4078904,0.67032886,0.20078291,0.2785685,-0.15936828,-0.37774286,0.20305514,0.93101263,-0.99582773,0.5340936,-0.50823456,-0.3776678,-0.09939403,-0.2826014,0.34095168,0.9988022,-0.6609605,0.11425231,0.119306184,-0.07506429,0.50836456,0.3984019,0.01538199,0.12952891,-0.3609952,-0.6220899,-0.22940834,0.0642438,-0.4373997,-0.7070289,-0.8356086,0.8549064,0.2044482,1,-0.10845123,0.57870454,0.08712816,-0.08417262,-0.6906366,-0.35091478,0.7017758,-0.12317245,0.5209379,-0.4135884,0.058298428,-0.19444339,-0.35658926,-0.6787435,-0.052370735,-0.60587204,-0.596171,0.01634776,-0.061114658,-0.6912452,0.30262572,-0.030222012,-0.51536584,-0.13928033,-0.7879585,0.35782138,-0.51759243,0.4051305,0.057637252,0.14782643,-0.28626084,-0.10929295,0.29216576,0.027318055,0.26902452,-0.5514113,-0.3020671,-0.36916116,0.109684065,-0.28698438,0.99999934,0.26389086,-0.7540742,-0.18563724,0.998113,-0.0605892,-0.29492825,-0.9999003,0.083596185,-0.52407885,-0.39437628,-0.005307461,0.38836998,0.28629184,0.10125767,-0.24740627,0.3933117,-0.5700652,0.18746695,0.05189974,-0.15897332,0.060860284,-0.99986804,-0.99729943,-0.9778796,0.3860367,-0.25743023,0.6136927,0.21192294,0.19128814,0.793666,-0.34700525,0.11197978,-0.0789484,0.33933955,-0.38955984,0.27452832,-0.47399595,-0.10580307,-0.24747393,0.2227742,-0.9807196,-0.9997555,-0.3945808,-0.7095281,0.32860726,0.2716439,0.052640747,-0.97439295,-0.41588506,0.039676417,-0.31809267,-0.27045518,0.31711465,0.33471113,0.25366405,0.37512338,-0.06679099,0.4834519,0.20141396,-0.0712648,-0.21620005,0.3816865,-0.5790813,-0.35145006,0.29121906,-0.4940883,0.52764904,0.26022813,0.04972712,-0.4587973,-0.26880267,0.10818802,-0.9307958,-0.83568484,-0.3867323,0.30166844,-0.69942,-0.16544974,-0.6006248,-0.043572072,0.26806414,-0.09848171,0.9999785,0.3199315,0.34997874,0.5482411,0.36560202,-0.18003033,-0.15805425,-0.34368506,0.37895107,0.4125433,-0.560839,0.6395466,-0.32690874],
    [231,1,"CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O",0.9287576,0.575563,-0.44927177,0.09372129,-0.45702937,0.48265564,-0.07379623,-0.5742785,0.79180616,-0.11921614,-0.81824225,-0.3013998,0.12820518,0.31848362,-0.44536746,-0.2754366,0.65978515,0.18136732,0.50921255,0.06128534,0.40916747,0.59061515,-0.054964826,-0.2943095,-0.6722905,-0.7686756,-0.27425182,-0.663471,-0.13809742,-0.5162968,0.298582,-0.71224445,0.036036123,-0.5922477,0.35433307,-0.17771257,-0.6219542,0.271897,0.99977636,0.84868425,-0.24221903,-0.5147368,-0.047592316,0.7178336,0.07776899,0.64013517,-0.12926018,-0.58860844,0.9930917,0.0838818,0.22803286,0.4596871,-0.80118513,-0.058472633,0.019785576,-0.49532256,0.8317202,-0.8509822,0.3500633,0.28015688,0.009806244,-0.54014206,0.7807511,-0.02877227,0.008694967,0.5164422,-0.6427982,-0.25066155,0.64180523,-0.35178095,-0.73964655,-0.42384118,0.11065386,0.89379275,-0.5522939,-0.37757546,-0.51946306,0.1527389,0.3321627,-0.9999733,0.5146698,-0.4946601,-0.83677155,0.35282904,0.4813862,-0.8467543,-0.497045,-0.07522089,0.2477785,0.8499099,0.6332292,-0.46211806,-0.12048166,-0.5616397,0.9999163,-0.565942,-0.22493538,0.5134979,-0.59272,0.038837884,0.6924478,-0.25349182,-0.34496453,0.6515405,-0.9995232,-0.71878463,-0.35919842,-0.018711787,-0.96721476,-0.11369414,0.51856047,-0.4531157,-0.565717,-0.6016001,-0.031587638,0.08606175,0.24566725,0.062894255,0.8956289,-0.13745975,-0.20819855,0.3844565,-0.83379436,-0.14809106,-0.7278858,0.19293128,0.2798593,0.055703882,0.86529684,0.99987483,0.16724345,-0.15720169,-0.27572203,0.09901315,0.32530898,-0.9584371,0.01794074,-0.7569695,-0.6703853,-0.14859748,0.99833506,0.32343578,-0.5222515,-0.1308991,-0.42117828,-0.19660753,0.44773152,-0.6167728,-0.997552,0.30102336,-0.78791225,-0.9479828,-0.32110786,-0.042638503,-0.03014641,0.7540731,-0.11893084,-0.9327779,-0.9240442,-0.7616906,0.27495724,-0.86631876,0.49355638,0.6350334,0.45911276,0.47671777,-0.16664243,-0.6898607,0.655284,0.038892977,0.40711644,0.8302923,0.24833511,-0.75072014,0.49705186,-0.90215653,-0.45172736,-0.15860432,-0.5977238,-0.38328582,0.4619591,-0.99972326,0.35001618,-0.57504046,0.8122785,0.18841384,-0.16652174,0.72005045,-0.07182064,0.118801214,-0.8962479,-0.37866157,0.18683834,-0.24317873,-0.18370989,0.06778185,0.35496885,-0.6115253,-0.6441476,0.8417034,0.5117505,-0.825379,0.8781753,-0.20810783,0.16510408,-0.2973685,0.45848992,0.36880443,-0.7671459,-0.9999619,-0.002053096,0.18048486,0.17983906,-0.52587456,0.45599484,-0.033485755,-0.7053388,-0.2202647,0.71894205,-0.6472183,0.12940468,-0.37346265,-0.3147242,-0.00838429,0.97687143,0.5762235,-0.35140982,-0.18907398,0.5371389,-0.77860385,-0.43933466,-0.16806081,0.417655,0.16801985,0.12369035,0.48167488,-0.009221204,-0.6725063,0.053865295,0.19372487,0.93322,0.4520588,0.45522743,0.19912268,-0.98048526,-0.25061575,-0.52336746,-0.681821,-0.8389818,0.6583411,0.47116315,-0.9997154,-0.38660443,0.8825011,-0.1244143,-0.58160985,0.40864375,0.1340665,-0.6990649,0.14826469,-0.24008001,0.47057456,0.50617945,-0.12852558,-0.21957768,0.79492617,-0.5214674,-0.2215683,0.74440956,-0.22817273,0.4785916,0.99461293,-0.5898446,-0.5203402,0.33097905,-0.82655066,0.5319629,-0.41452372,0.3593212,0.6937208,0.5687347,0.9540288,-0.31347567,-0.6791316,-0.58809394,-0.05951512,0.3606384,0.5749323,-0.27498066,-0.3972564,0.79072344,0.16478428,-0.721121,0.54380965,-0.3741433,-0.6909666,-0.997879,-0.9908397,-0.39946812,0.3285964,0.57276857,0.3094676,-0.6367258,0.102730274,-0.6771684,-0.7754715,-0.9970673,-0.79282564,0.6986116,0.38154358,-0.29874048,0.31035385,0.23395553,0.10056388,-0.9841331,-0.80602133,-0.4890469,-0.6927358,-0.9531963,-0.6410057,-0.08108244,0.3669363,0.1745392,-0.7239498,0.463865,-0.6357967,-0.13333592,-0.849228,-0.4221858,-0.751685,0.29522786,0.25891405,-0.17527741,0.1089651,-0.5703026,0.74891347,0.2037923,-0.33639762,0.7015827,0.37232667,-0.75498927,0.106088445,0.25477135,0.3167592,-0.30504394,-0.41666195,0.6598482,0.23327902,0.535978,-0.9488955,-0.2624483,0.72982776,0.39233592,0.20339087,0.5741182,-0.2708899,0.24869864,0.9998632,0.008292411,0.20312165,0.5647308,-0.29377186,0.10663529,-0.23848161,-0.54446805,-0.051121518,-0.61963326,0.4601422,0.13971812,-0.38295606,-0.6505802,-0.48574895,-0.64647335,-0.42687267,0.18649456,1,-0.11928263,0.1237567,0.12807396,0.6315201,0.33484384,0.5309878,0.3006406,-0.1882281,0.55863816,0.14363995,-0.15232587,0.088761665,-0.423136,-0.21427697,0.013666257,0.34999448,-0.03280504,0.60629654,0.56142,-0.99491054,0.40394962,-0.81225413,-0.8455117,0.43439558,0.99172115,0.27842975,-0.01208967,-0.044662956,0.32108703,0.26766562,0.72733605,0.76382595,-0.8777398,0.016764767,-0.5421735,0.0608396,-0.39742503,-0.6665582,0.42518842,-0.42798316,0.9998761,-0.14598764,-0.95105034,-0.47075325,0.999051,-0.79927427,0.10262436,-0.99875414,-0.5942329,-0.9605104,0.005641833,-0.63401663,0.32336086,0.6310698,0.30116493,-0.81777203,0.3407055,0.013366131,-0.11556397,0.21412498,0.101728,-0.28382456,-0.9995907,-0.9999991,0.24128526,-0.14744133,0.24958909,0.7317649,0.3137228,-0.35778126,0.46128023,-0.9140987,0.11929412,-0.46670803,0.112750955,0.7089326,-0.7902126,0.6447498,-0.1455786,-0.12602304,-0.70630926,0.9572579,-0.9967783,-0.005504035,-0.027391318,0.1739996,0.69531894,-0.29659042,0.6125852,0.80089235,0.49308598,-0.13162187,-0.31227094,-0.04648941,-0.41378236,-0.9623023,-0.25914598,-0.989141,0.4573495,-0.1304127,-0.52288026,0.28776115,-0.76302606,0.298899,-0.77110434,0.43756378,-0.99727017,0.3428496,0.06342389,-0.025500864,-0.06381036,-0.10853195,0.26278907,0.15735656,-0.4646522,0.5910377,-0.68661016,0.99965024,0.11260297,-0.75656873,0.61195314,0.38819167,-0.2709875,0.99996394,0.32881978,-0.85021836,0.36799216,-0.75248456,0.18730447,0.052813917,-0.99971396,-0.38912374,0.6084226,-0.08914101,0.47165948,-0.25755098],
    [232,1,"CC1COC(Cn2cncn2)(c2ccc(Oc3ccc(Cl)cc3)cc2Cl)O1",-0.11286157,-0.53701115,0.18946607,-0.29385468,0.08706326,-0.43755916,-0.7467537,-0.22451712,-0.3291291,-0.13665573,0.38578358,0.3726663,0.07703368,-0.024562195,-0.04589762,0.01206963,0.19614328,-0.72074074,0.020094646,0.16872111,0.01762565,0.49847364,-0.30276987,0.030897165,-0.031075025,-0.8707011,0.1860446,-0.22846758,0.192367,-0.104857825,0.18368118,-0.55947185,-0.017542342,0.2069326,0.5292219,0.19104195,-0.5903272,-0.06971901,0.9994322,-0.8621515,0.30466676,0.8338564,-0.20037626,0.6329262,-0.019441135,0.53256243,-0.25541598,0.19083574,0.842257,-0.48565075,0.7593534,0.32199988,-0.43744153,0.65302914,-0.02848431,0.5795559,-0.39520434,-0.7156269,0.31344905,0.047853224,-0.37564147,0.117804326,0.60995096,-0.034130137,-0.23746091,0.108497255,-0.06107641,0.53247553,-0.46197715,-0.1985432,-0.7922002,-0.70432216,0.32873264,-0.62976164,0.4508282,-0.20704013,0.16601054,0.11317916,-0.48787782,-0.99772775,0.74439025,-0.4431272,-0.9707017,0.13976507,-0.4810752,-0.885726,0.17759985,-0.1821181,-0.3193148,-0.17948115,0.31399336,-0.119255446,0.6125859,0.3946966,0.9979376,-0.41715482,0.54112124,-0.3473517,-0.0864421,-0.16920482,0.1591803,-0.3249772,-0.30718553,0.98119944,-0.9984999,-0.96508926,0.076351024,0.32642448,0.95742565,0.69050705,0.7340426,-0.23276778,0.49483842,0.24012938,0.13617268,0.42573065,-0.79782456,0.63118,0.932919,-0.08093681,-0.35181367,-0.22950885,-0.33910555,-0.081669144,-0.5454305,-0.5326615,0.2830456,-0.74630666,0.047899716,0.99877846,0.060003676,-0.16955242,0.5647531,0.649723,0.14796901,-0.99406433,-0.58354336,0.15589216,0.4670795,-0.6665989,-0.99999917,-0.3383839,0.5263162,-0.28108838,-0.16753334,0.3767878,-0.04590423,-0.25255683,-0.9902589,-0.29715455,0.71705824,-0.8910157,-0.30583847,0.5477027,-0.24523436,0.10516599,0.40879795,-0.7067938,-0.30171996,-0.9619621,-0.41626552,-0.86691374,-0.47234765,-0.28890377,0.5252612,0.7533715,-0.050673768,0.13334274,-0.28815338,0.096098,0.25408337,-0.18887007,-0.21644513,-0.15522584,0.46214902,-0.2893747,-0.4186116,-0.13245927,-0.87401724,-0.3552599,0.4594254,-0.6171417,-0.6564244,0.41522652,0.69320554,-0.4796181,-0.1358978,0.8004742,-0.46036372,-0.21996447,-0.26403895,-0.16516614,-0.19971658,0.02054229,-0.40709776,0.6578542,0.18960124,-0.78174514,-0.19128582,0.512315,-0.38703233,-0.5566388,-0.26678884,-0.21743508,0.7315119,-0.09468518,0.5720285,-0.48916507,-0.51240027,-0.9998913,-0.5759503,-0.20627275,-0.22950512,-0.1320909,0.14800188,-0.4160631,-0.10235981,0.3576991,-0.3391371,-0.6332923,-0.6836813,-0.34408498,0.7372017,0.359393,-0.95204026,0.06485495,0.28655708,0.59023255,0.6642407,0.6511477,0.13960926,-0.67881644,0.4991174,0.4303918,0.863659,-0.29610726,0.09937958,-0.6320315,-0.05827333,0.096550055,0.95442855,0.04333192,-0.50996375,-0.2816579,0.73301345,-0.5221875,0.75372094,0.18604094,0.6806024,0.7366976,-0.09187732,0.018413741,0.24483216,0.36964104,-0.4127876,-0.36307323,0.66455436,0.3911685,-0.02492257,-0.16759978,0.060115643,-0.8042099,-0.106945515,-0.1734399,0.45353252,-0.020027488,0.64630497,-0.23760489,0.91430527,0.33247903,0.14364837,0.9986596,-0.48009574,-0.21874742,-0.085981466,0.38513312,-0.04749587,-0.6257894,0.61824584,-0.00270255,0.78144926,0.98995817,0.37737662,0.5076327,-0.25437877,0.5892682,0.5265067,0.9013515,0.7535758,-0.02153826,0.5311951,0.57936764,0.3082088,-0.002689206,-0.5317539,-0.30479705,0.9999999,-0.98119086,0.34102246,0.22202592,-0.13368183,0.056199785,-0.16676639,0.12611069,0.6913797,0.38716894,-0.9943497,-0.1553155,0.8304963,-0.05629126,-0.093533695,0.54196215,-0.27958748,0.16355301,0.7323165,-0.6989604,0.24965759,-0.64248353,-0.9999474,-0.05963077,-0.34277153,-0.7096537,0.11265509,-0.68662024,0.024047175,-0.40901712,-0.5632981,0.4107213,0.16670017,0.007884217,0.026497649,-0.6416727,0.44353807,-0.15931956,0.23525687,0.7128798,0.41429088,0.6861263,-0.4144867,0.44719994,-0.7873817,-0.5358365,0.2714852,-0.007693243,0.17037287,-0.75802964,-0.8424211,0.57727706,-0.5639148,-0.914744,-0.76916784,-0.26682863,0.6404712,-0.07948371,-0.077141285,0.5433362,0.85945696,0.99894935,-0.09108041,-0.010288156,-0.30096245,0.76481104,0.084826544,0.37943074,-0.79914176,-0.1989636,-0.339497,-0.3754141,0.32444307,-0.4500085,-0.41933942,0.60063505,0.077525005,-0.80228746,0.44801667,-0.9999998,-0.07942524,-0.29544088,0.17622009,0.38037017,0.5653381,0.053090602,0.032661036,0.5531992,-0.2360625,0.40218332,0.385417,0.26037213,0.1266202,-0.14872038,0.09022574,-0.13525765,-0.27605203,0.37774268,0.4875951,0.59643483,0.24307564,-0.31674376,0.39310253,-0.43321362,0.84039783,0.6196175,-0.38700214,0.79762316,0.09334151,-0.51707995,-0.8292418,0.10759878,0.5817285,0.31603336,-0.57469016,0.44402888,-0.13147618,0.30893636,0.47328183,-0.50580597,0.99999964,-0.33330724,-0.9503771,-0.45091677,0.9967562,-0.6660241,0.3408055,-0.9999195,0.730217,-0.89680785,0.07839507,0.25122076,-0.064032055,-0.2501125,-0.39610118,0.18644844,0.118287385,0.05838411,0.49837336,-0.16313744,-0.2741593,-0.24163558,-0.9999622,1,0.43675235,-0.67339325,0.27445948,-0.033055164,0.18362352,0.004728437,0.043866146,-0.29227197,-0.38827112,0.5208909,-0.8007926,-0.5709879,-0.6382488,0.116936006,0.4031904,0.10409307,-0.72855026,0.885559,-0.9994132,0.85990155,-0.6112544,-0.15479068,0.25639662,0.36980218,-0.7166889,0.5086684,0.033124194,-0.11514252,-0.2358774,-0.39672482,0.7430487,0.97250295,0.29795685,0.50641096,0.1867954,0.45877102,0.03454487,0.45227647,-0.3118571,-0.52170235,-0.10738208,-0.1173884,-0.9609322,0.47907206,0.1359235,0.1277026,0.25161526,-0.3694773,0.027094353,-0.033267558,-0.74596393,0.14826478,0.33403707,0.99870145,-0.33713973,0.10412914,-0.10804528,0.4135566,0.42885613,0.999805,0.53949946,0.028465806,0.11418561,-0.3477723,0.22655056,0.17715834,-0.9978296,-0.20102872,-0.00196777,0.03391484,-0.33772972,0.04726286]
]}