smiles stringlengths 10 447 | coords listlengths 6 189 | energy listlengths 1 1 | forces listlengths 6 189 |
|---|---|---|---|
[H:13]/[C:4](=[N:16]/[H:14])/[N:15]([H:12])[S:20][H:11].[H:7][C:2]([H:8])([C:1]([H:6])([C:3]([H:9])([H:10])[F:19])[O:17][H:5])[F:18] | [
-1.8792630434036255,
-0.2718999981880188,
-0.25459998846054077,
-0.5073670148849487,
-0.6509720087051392,
-0.7340919971466064,
-2.1968870162963867,
1.1311659812927246,
-0.5833539962768555,
2.853347063064575,
1.1037449836730957,
-0.5319390296936035,
-2.498634099960327,
0.13633300364017487,
... | [
-590405.6875
] | [
21.80832862854004,
-39.184967041015625,
23.51950454711914,
-77.29112243652344,
34.28050994873047,
-47.94636917114258,
36.03005599975586,
18.293481826782227,
54.847591400146484,
-55.259517669677734,
-33.476192474365234,
5.664134502410889,
54.493438720703125,
-49.506439208984375,
-47.71430... |
[H:5][C:1]([H:6])([C:2]([H:7])([H:8])[Cl:15])[S:13][H:4].[H:9][O:11][C:3](=[O:12])[S:14][H:10] | [
-2.7676479816436768,
-0.16616199910640717,
0.6737319827079773,
-1.3882219791412354,
-0.6672139763832092,
1.0670640468597412,
2.308121919631958,
0.6770730018615723,
0.33434298634529114,
-2.1942059993743896,
0.5673270225524902,
-1.5056730508804321,
-3.3745369911193848,
-0.9880959987640381,
... | [
-957291.375
] | [
-0.09442218393087387,
-4.064945697784424,
-0.2598062753677368,
-5.247533321380615,
0.18235674500465393,
4.241671085357666,
3.39626145362854,
-14.063952445983887,
-1.12602961063385,
-1.3749582767486572,
1.086101770401001,
1.806046962738037,
2.5974462032318115,
3.693514823913574,
1.2984254... |
[H:5][C:1]([H:6])([C:2]([H:7])([H:8])[Cl:15])[O:11][H:4].[H:9][O:12][C:3](=[S:14])[S:13][H:10] | [
3.8752450942993164,
0.23298999667167664,
-0.36140701174736023,
2.605402946472168,
0.02572000026702881,
0.45478400588035583,
-2.5515379905700684,
0.47418901324272156,
-0.026340000331401825,
4.308362007141113,
2.080673933029175,
0.05571400001645088,
3.6178948879241943,
0.48460400104522705,
... | [
-957275.1875
] | [
-2.1771841049194336,
-6.002652168273926,
-3.3946616649627686,
3.3251962661743164,
1.1352813243865967,
4.388825416564941,
-2.5784943103790283,
-11.172273635864258,
4.914376735687256,
3.9791221618652344,
-2.96394419670105,
1.8618481159210205,
0.8567320108413696,
-0.3689018189907074,
3.0582... |
[H:9]/[C:4](=[C:5](\[H:10])/[S:17][C:6](=[O:12])[H:11])/[F:15].[H:7]/[C:1](=[C:2](/[C:3](=[S:16])[H:8])\[F:14])/[F:13] | [
3.555933952331543,
-0.07960599660873413,
-0.2938460111618042,
2.289386034011841,
-0.5049669742584229,
-0.23973500728607178,
1.4039310216903687,
-0.27397099137306213,
0.8848909735679626,
-3.452177047729492,
-0.5803769826889038,
0.13017000257968903,
-2.685486078262329,
-0.5273029804229736,
... | [
-880201.25
] | [
-6.306519031524658,
-8.194679260253906,
-15.141030311584473,
13.193094253540039,
2.1174399852752686,
21.907135009765625,
12.842134475708008,
-1.9992895126342773,
4.3288373947143555,
0.5339704751968384,
0.19454698264598846,
0.1890210658311844,
1.3890529870986938,
3.9476587772369385,
-0.32... |
[H:8][C:1]([H:9])([H:10])[C@@:2]([C:3]#[N:20])([F:21])[Cl:23].[H:11][C:4]([H:12])([H:13])[C:5]([C:6]([H:14])([H:15])[H:16])([C:7]([H:17])([H:18])[H:19])[F:22] | [
-3.1809089183807373,
-1.0799829959869385,
1.0689769983291626,
-2.5170090198516846,
-0.313508003950119,
-0.05556099861860275,
-1.0442229509353638,
-0.4491789937019348,
-0.025189999490976334,
3.053455114364624,
0.22427000105381012,
1.5272849798202515,
3.000910997390747,
0.04779599979519844,
... | [
-620339.0625
] | [
-1.3945919275283813,
-0.7127768397331238,
0.8327866792678833,
2.236121654510498,
0.31002935767173767,
4.413325786590576,
18.146774291992188,
-1.5529049634933472,
-0.3607528507709503,
-0.6102851629257202,
0.4716721773147583,
1.2248843908309937,
3.595503091812134,
-6.484634876251221,
1.516... |
[H:7][C:3]#[C:2][C:1](=[S:14])[S:13][H:6].[H:10][C:5](=[O:11])[C:4]([H:8])([H:9])[F:12] | [
1.7950700521469116,
0.13015399873256683,
-0.17208600044250488,
2.373244047164917,
-0.5584719777107239,
1.0617589950561523,
2.959563970565796,
-1.1467519998550415,
1.9496469497680664,
-2.758366107940674,
-0.7049379944801331,
0.5723400115966797,
-3.485377073287964,
0.3938579857349396,
-0.2... | [
-730956.125
] | [
30.248605728149414,
-33.87119674682617,
19.205585479736328,
-4.526369094848633,
13.479934692382812,
-24.992807388305664,
-20.36883544921875,
7.931332111358643,
22.673437118530273,
-32.126220703125,
-16.385499954223633,
-30.081226348876953,
28.766864776611328,
2.7658824920654297,
14.69161... |
[H:3][S:7][C:1](=[S:8])[C:2]#[N:4].[F:5][F:6] | [
1.5445380210876465,
-0.15274100005626678,
-0.023838000372052193,
1.6233129501342773,
1.313241958618164,
-0.29496899247169495,
0.5000200271606445,
-2.1468589305877686,
-0.2868410050868988,
1.8354970216751099,
2.5227649211883545,
-0.1297069936990738,
-4.631000995635986,
0.49597299098968506,
... | [
-707466.375
] | [
66.87751770019531,
63.932594299316406,
-15.358182907104492,
22.632726669311523,
166.18807983398438,
50.647769927978516,
-13.9788236618042,
36.05400085449219,
6.168918609619141,
-36.58223342895508,
-182.51466369628906,
-35.38629913330078,
5.70114278793335,
-24.81524658203125,
-35.35106658... |
[H:6][C:2](=[S:9])[N:7]([H:5])[O:8][H:4].[H:3][C:1]([Cl:10])([Cl:11])[Cl:12] | [
-1.7432090044021606,
0.12335000187158585,
0.4923129975795746,
3.1483700275421143,
-0.06793399900197983,
-0.22846199572086334,
-2.120163917541504,
0.3871540129184723,
1.4751369953155518,
0.9729920029640198,
0.5360490083694458,
0.16554799675941467,
3.3010599613189697,
1.9558199644088745,
0... | [
-1247025.25
] | [
-14.529508590698242,
3.010165214538574,
14.498348236083984,
-5.686893939971924,
3.769273281097412,
2.8440980911254883,
-1.9780858755111694,
1.206960678100586,
-3.1783182621002197,
0.6120662689208984,
10.7750825881958,
-2.198153018951416,
-3.3806300163269043,
-12.003979682922363,
-3.33636... |
[H:13][C:7]#[C:6][C:5](=[S:15])[C:4]([H:10])([H:11])[H:12].[H:9][C:3]#[C:2][C@:1]([H:8])([F:14])[Cl:16] | [
2.0288820266723633,
-0.2519330084323883,
0.21174399554729462,
3.482805013656616,
-0.11874400079250336,
0.20923399925231934,
4.682431221008301,
-0.04394000023603439,
0.21426300704479218,
-2.695296049118042,
-1.2262790203094482,
1.3991869688034058,
-2.352073907852173,
-0.45591801404953003,
... | [
-770834.6875
] | [
3.211345672607422,
1.3535209894180298,
6.21710205078125,
12.812677383422852,
0.19611701369285583,
-0.4476545453071594,
-12.25699520111084,
0.2206220030784607,
0.6112539768218994,
0.7681654095649719,
-0.5836397409439087,
1.5678759813308716,
2.383929491043091,
-2.9722461700439453,
-3.78573... |
[H:12][C:4](=[C:3]([C@@:2]([H:10])([C:1]([H:7])([H:8])[H:9])[S:22][H:11])[Cl:24])[H:13].[H:16][N:20]1[C:6](=[N:21][C:5](=[N:19]1)[N:18]([H:14])[H:15])[S:23][H:17] | [
3.81715989112854,
0.4960870146751404,
1.917091965675354,
3.0441501140594482,
0.6314939856529236,
0.6066380143165588,
2.9501829147338867,
-0.6659470200538635,
-0.15669499337673187,
1.8091579675674438,
-1.2170519828796387,
-0.5521249771118164,
-5.218886852264404,
0.09972500056028366,
0.115... | [
-1073543.125
] | [
0.920378565788269,
0.4097035527229309,
1.065004825592041,
-2.337101459503174,
-1.6194912195205688,
3.01277756690979,
-5.064869403839111,
-0.9825511574745178,
-1.3228307962417603,
4.268182754516602,
1.0232200622558594,
0.9047980308532715,
-2.4264886379241943,
1.7798960208892822,
-1.424542... |
[H:8][C:2](=[C:1]([F:21])[F:22])[H:9].[H:17][C@@:6]1([C:4]([N:20]1[H:16])([C:3]([H:10])([H:11])[H:12])[C:5]([H:13])([H:14])[H:15])[C:7]([H:18])([H:19])[Cl:23] | [
2.1126670837402344,
-0.7067800164222717,
-0.08287400007247925,
2.533613920211792,
-1.6510939598083496,
0.7359219789505005,
-2.8978219032287598,
0.11605600267648697,
0.26604101061820984,
-1.707381010055542,
-0.7753310203552246,
-0.0181489996612072,
-1.998121976852417,
-2.256218910217285,
... | [
-620239.9375
] | [
35.73907470703125,
-12.615588188171387,
-23.669504165649414,
2.8023951053619385,
5.556744575500488,
-0.18966852128505707,
-4.151519298553467,
-2.5337769985198975,
-1.2316126823425293,
-15.683913230895996,
8.44668197631836,
7.563380241394043,
-0.015482079237699509,
1.1311630010604858,
-1.... |
[H:3][C:1]([H:4])([H:5])[N:10]([H:6])[C:2](=[S:12])[N:11]([H:7])[S:13][H:8].[H:9][Cl:14] | [
-0.018400000408291817,
2.708420991897583,
-0.03116700053215027,
-0.37341099977493286,
0.2421340048313141,
-0.1173660010099411,
0.8532779812812805,
3.3600471019744873,
-0.11154700070619583,
-0.720969021320343,
2.9908430576324463,
-0.8261409997940063,
-0.4848319888114929,
2.894278049468994,
... | [
-907671.4375
] | [
-0.2943018078804016,
1.832220435142517,
-0.5286888480186462,
1.503516674041748,
12.280496597290039,
2.6739838123321533,
-3.029966115951538,
-2.5157346725463867,
0.2950204014778137,
1.7915194034576416,
-0.8404103517532349,
2.1058201789855957,
0.5874794721603394,
-0.26509860157966614,
-1.5... |
[H:10][C:1](=[C:2]1[C:3]([C@@:4]2([C@@:6]([C:5]2([H:15])[H:16])([S:24]1)[H:17])[H:14])([H:12])[H:13])[H:11].[H:20]/[C:7](=[C:8](/[C:9](=[S:25])[H:21])\[F:23])/[N:22]([H:18])[H:19] | [
2.2173149585723877,
2.3534650802612305,
-0.595067024230957,
2.0599400997161865,
1.0862029790878296,
-0.22820700705051422,
2.8238890171051025,
-0.13017499446868896,
-0.8290070295333862,
2.640805959701538,
-1.1328010559082031,
0.289887011051178,
1.9506930112838745,
-2.3789920806884766,
0.7... | [
-816376.1875
] | [
-0.8393442630767822,
-1.0776753425598145,
0.07109708338975906,
1.243166208267212,
3.678771495819092,
-0.09644164144992828,
-0.19211368262767792,
-0.3775666058063507,
-1.2774991989135742,
4.053565502166748,
2.5582380294799805,
3.545437812805176,
-0.26447248458862305,
-4.116096496582031,
0... |
[H:5][C:1]([H:6])([H:7])[C:2]([H:8])([C:3]([H:9])([H:10])[H:11])[F:14].[H:12][C:4]([H:13])([F:15])[F:16] | [
-0.22475400567054749,
0.2748189866542816,
0.7047790288925171,
-1.3988620042800903,
-0.039361998438835144,
-0.20067599415779114,
-2.50136399269104,
0.9993450045585632,
-0.1484690010547638,
2.1777379512786865,
0.30316901206970215,
-0.5103679895401001,
0.263357013463974,
1.2057549953460693,
... | [
-286980.53125
] | [
-33.01274108886719,
2.5539631843566895,
53.836524963378906,
1.7172964811325073,
10.70627498626709,
0.17520031332969666,
-2.01422381401062,
-0.8472121953964233,
0.28828495740890503,
19.4576473236084,
8.480181694030762,
-14.512784957885742,
-8.89006233215332,
-2.2448315620422363,
6.5298418... |
[H:3][O:5][C:1](=[S:9])[O:6][H:4].[C:2]([F:7])([F:8])([Cl:10])[Cl:11] | [
-2.982628107070923,
-0.338360995054245,
0.09858299791812897,
1.7532520294189453,
0.09722299873828888,
-0.21426799893379211,
-4.688826084136963,
-0.274821013212204,
-0.6290990114212036,
-1.3845850229263306,
-0.7239900231361389,
0.9565790295600891,
-4.16868782043457,
-0.8893529772758484,
-... | [
-1095758.5
] | [
3.293691396713257,
6.8061041831970215,
-2.116626501083374,
6.374603748321533,
3.4294750690460205,
0.8173508644104004,
2.038776159286499,
-1.9405925273895264,
1.8301759958267212,
-0.11793701350688934,
-0.7445177435874939,
-0.5364108681678772,
-2.9048891067504883,
1.5764079093933105,
-2.23... |
[H:12]/[C:4](=[C:5](/[H:13])\[C:6]([H:14])([Cl:18])[Cl:19])/[C:3]([H:10])([H:11])[S:17][H:9].[H:7]/[C:1](=[C:2](\[H:8])/[F:16])/[F:15] | [
-2.7772459983825684,
-1.3898849487304688,
0.257425993680954,
-4.021180152893066,
-0.9513000249862671,
0.3542029857635498,
-0.32796400785446167,
2.4276769161224365,
0.039875999093055725,
-0.03540800139307976,
0.9555109739303589,
-0.05172299966216087,
1.150858998298645,
0.3701559901237488,
... | [
-1099173.75
] | [
-13.67085075378418,
-7.946625709533691,
10.133930206298828,
2.945404052734375,
-0.24970188736915588,
-0.35698312520980835,
3.648460626602173,
-1.7483994960784912,
-0.3871634602546692,
2.1453566551208496,
4.017261505126953,
2.0094187259674072,
0.502452552318573,
4.289285659790039,
0.63603... |
[H:8][C:2](=[O:16])[C:1]([H:6])([H:7])[F:17].[H:12][C@@:4]([C:5]([H:14])([H:15])[F:18])([C:3]([H:10])([H:11])[S:19][H:9])[S:20][H:13] | [
-2.6822869777679443,
-0.5529630184173584,
0.4841090142726898,
-3.3624510765075684,
-0.07072000205516815,
-0.8364260196685791,
1.8842990398406982,
1.0879850387573242,
-0.4676879942417145,
1.8869140148162842,
-0.26929500699043274,
0.26332199573516846,
0.5370010137557983,
-0.9029920101165771,... | [
-795529.3125
] | [
-69.01277923583984,
-3.826103687286377,
-35.91778564453125,
4.22578239440918,
-13.11992359161377,
19.93231201171875,
-30.566789627075195,
-18.535085678100586,
-39.1292839050293,
7.816725730895996,
0.6027350425720215,
21.61248779296875,
-59.04580307006836,
-10.913496017456055,
-23.0252189... |
[H:7][C:1]1=[N:15][N:14]([C:2](=[N:16]1)[S:18][H:8])[N:13]([H:5])[H:6].[H:11][C:4]([H:12])([C:3]([H:9])([H:10])[Cl:19])[F:17] | [
-1.7720489501953125,
2.0988190174102783,
-0.2793219983577728,
-2.1961510181427,
0.058692000806331635,
-0.16683299839496613,
3.067889928817749,
0.6025609970092773,
-0.31730198860168457,
3.230468988418579,
-0.1844940036535263,
0.9617499709129333,
-0.6634010076522827,
-0.19016200304031372,
... | [
-837377.625
] | [
-0.0963752344250679,
3.7502171993255615,
-1.3923697471618652,
4.738186359405518,
-1.1833865642547607,
5.178990364074707,
-0.17508766055107117,
3.5423331260681152,
2.0191969871520996,
22.872079849243164,
7.9049153327941895,
-11.967429161071777,
-1.0853488445281982,
-1.654922366142273,
-3.... |
[H:11][C:5]1=[C:4]([C:3](=[S:15])[C:7](=[C:6]1[H:12])[H:13])[H:10].[H:9]/[C:2](=[C:1](/[H:8])\[Cl:16])/[F:14] | [
-1.358989953994751,
0.34887999296188354,
-0.4020009934902191,
-1.2966070175170898,
1.6491789817810059,
-0.16328200697898865,
0.9267470240592957,
-0.7151089906692505,
-0.1336659938097,
0.658719003200531,
0.24119600653648376,
0.9704220294952393,
1.761348009109497,
0.9811919927597046,
1.146... | [
-770816.0625
] | [
-52.10332107543945,
28.096158981323242,
-11.611610412597656,
-16.932836532592773,
-5.020334720611572,
-0.07693606615066528,
10.85592269897461,
-20.18971824645996,
-0.877347469329834,
35.62619400024414,
15.58408260345459,
26.818185806274414,
1.3797502517700195,
-4.348260879516602,
-0.5253... |
[H:10][C:3](=[O:14])[C:2]([H:8])([H:9])[C@:1]([H:7])([F:15])[Cl:16].[H:11][C:4]1([C:5]([C:6]1([H:13])[Cl:19])([H:12])[Cl:18])[Cl:17] | [
-2.0658810138702393,
0.2668690085411072,
-0.7422839999198914,
-2.9752020835876465,
1.2275830507278442,
-0.005338999908417463,
-3.46936297416687,
0.7541229724884033,
1.3470560312271118,
1.2548840045928955,
-0.5737339854240417,
-0.8005769848823547,
1.571207046508789,
-0.5383470058441162,
0... | [
-1410770.875
] | [
-34.44385528564453,
26.00204849243164,
26.83962631225586,
-0.22684162855148315,
-3.433588743209839,
-0.05448254942893982,
2.441236734390259,
-5.935940265655518,
3.629848003387451,
71.96791076660156,
-30.977033615112305,
-56.18583679199219,
20.286279678344727,
-13.706933975219727,
11.3446... |
[H:10][C@:2]1([C:3]([N:20]1[H:13])([H:11])[H:12])[C:1]([H:8])([H:9])[F:21].[H:15][C:5]1([C:6]([C:7]([C:4]1([H:14])[Cl:23])([H:18])[H:19])([H:17])[F:22])[H:16] | [
4.1742119789123535,
-0.12411999702453613,
-0.3169499933719635,
2.9563980102539062,
0.48277899622917175,
0.31103500723838806,
2.706295967102051,
0.23810400068759918,
1.7499769926071167,
-1.6735329627990723,
0.5713179707527161,
0.0656690001487732,
-1.7753750085830688,
-0.519586980342865,
-... | [
-620316.375
] | [
0.14632557332515717,
1.1175687313079834,
9.230186462402344,
3.323211193084717,
4.583192348480225,
-3.282376289367676,
3.1999619007110596,
2.770029306411743,
6.623459339141846,
5.092709064483643,
-0.9105504751205444,
2.6429591178894043,
-0.08594001084566116,
-0.28640541434288025,
-3.92437... |
[H:4][C:1](=[C:2]([H:5])[S:8][C:3](=[S:9])[H:6])[F:7].[Cl:10][Cl:11] | [
-0.09019599854946136,
2.795201063156128,
-0.2659960091114044,
0.4992089867591858,
1.7823450565338135,
0.2558630108833313,
2.102847099304199,
-0.4941929876804352,
0.4940800070762634,
-0.002256999956443906,
3.317389965057373,
-1.2232149839401245,
0.24602800607681274,
1.619480013847351,
1.3... | [
-1212738.5
] | [
4.164487361907959,
85.34436798095703,
-50.301631927490234,
7.145076751708984,
-80.61771392822266,
71.30927276611328,
50.781646728515625,
-23.389741897583008,
-15.982481956481934,
4.484304428100586,
-33.2281494140625,
-10.973102569580078,
20.331134796142578,
2.532371759414673,
-53.4263153... |
[H:16][C:7](=[C:6]([H:15])/[C:5](=[C:4](\[H:13])/[Cl:19])/[H:14])[H:17].[H:11][C:3](=[C:2]([H:10])[C:1]([H:8])([H:9])[F:18])[H:12] | [
-3.623702049255371,
0.9350379705429077,
-0.8158270120620728,
-2.8676059246063232,
1.233016014099121,
0.5270670056343079,
-2.5671730041503906,
0.3059220016002655,
1.4128090143203735,
1.8046129941940308,
-0.4647679924964905,
0.41004401445388794,
2.9158198833465576,
-0.4018470048904419,
-0.... | [
-522488.3125
] | [
-39.384033203125,
11.969051361083984,
80.83118438720703,
-23.573644638061523,
-13.573345184326172,
-19.572912216186523,
13.530163764953613,
-78.72661590576172,
1.755375623703003,
25.27127456665039,
14.96760368347168,
17.865039825439453,
-50.09663391113281,
6.746094226837158,
22.134826660... |
[H:11]/[C:2](=[C:3](\[H:12])/[Cl:24])/[N:19](/[C:1](=[N:20]\[H:10])/[H:9])[N:18]([H:7])[H:8].[H:16][C:6]1([S:23][C:5](=[N:21][S:22]1)[C:4]([H:13])([H:14])[H:15])[H:17] | [
-4.133885860443115,
-0.522055983543396,
0.36462101340293884,
-1.6610840559005737,
-0.46198800206184387,
0.30549201369285583,
-1.2286490201950073,
0.7967829704284668,
0.3865390121936798,
4.674990177154541,
-0.03422100096940994,
1.368265986442566,
3.4299750328063965,
-0.21963800489902496,
... | [
-1073502.125
] | [
-0.6034121513366699,
0.1610131561756134,
-0.27055931091308594,
-5.026144981384277,
-0.685038149356842,
5.233635425567627,
-3.055321216583252,
-4.619627952575684,
2.886481761932373,
0.8711207509040833,
-0.7794626951217651,
1.0199886560440063,
-1.8001214265823364,
-2.2447283267974854,
0.85... |
[H:5][C:1]([H:6])([C:2]([H:7])([H:8])[Cl:15])[O:11][H:4].[H:10][O:12][C:3](=[S:14])[S:13][H:9] | [
1.9043890237808228,
0.9951769709587097,
-0.3779489994049072,
2.3775899410247803,
-0.09861200302839279,
0.5717589855194092,
-1.6514569520950317,
-0.2033119946718216,
0.00990699976682663,
1.3602579832077026,
2.3815760612487793,
0.8660730123519897,
0.8676750063896179,
0.80343097448349,
-0.6... | [
-957239.5625
] | [
63.6265983581543,
-9.431863784790039,
-23.93703842163086,
-0.43583786487579346,
8.101644515991211,
1.2615025043487549,
-15.078876495361328,
5.500222206115723,
-0.2368784248828888,
-1.1316859722137451,
1.2004374265670776,
2.297030210494995,
77.03363800048828,
-10.454547882080078,
-14.4620... |
[H:7]/[C:1](=[N:14]/[N:13]([H:5])[H:6])/[C@:2]([H:8])([F:17])[Cl:19].[H:10]/[C:3](=[N:15]/[H:9])/[N:16]([H:11])[C:4](=[S:18])[H:12] | [
-2.185012102127075,
0.29766398668289185,
0.4147079885005951,
-1.1638699769973755,
0.9757689833641052,
-0.456402987241745,
0.5054579973220825,
-1.3801339864730835,
0.8217470049858093,
2.345773935317993,
-0.6675140261650085,
-0.6507800221443176,
-2.3350160121917725,
-2.55387806892395,
-0.7... | [
-837333.625
] | [
-6.623560905456543,
-5.740844249725342,
-1.7343367338180542,
-10.502223014831543,
9.96675968170166,
0.4880507290363312,
8.071586608886719,
-21.185449600219727,
20.182331085205078,
5.210676670074463,
-3.0332815647125244,
3.376199722290039,
-2.3871703147888184,
4.415164947509766,
-1.859559... |
[H:3][C:1]([H:4])([H:5])[N:10]([H:6])[C:2](=[S:12])[N:11]([H:7])[S:13][H:8].[H:9][Cl:14] | [
-1.7201950550079346,
1.981948971748352,
-0.38108399510383606,
-0.17079900205135345,
0.25896701216697693,
0.5736770033836365,
-2.1244819164276123,
1.703631043434143,
-1.357498049736023,
-1.6024739742279053,
3.0686988830566406,
-0.33732300996780396,
-2.4282989501953125,
1.677528977394104,
... | [
-907647.875
] | [
-0.8494724035263062,
1.3427098989486694,
-0.2947097420692444,
3.714561939239502,
-2.0566108226776123,
14.420503616333008,
0.7529797554016113,
0.7850977182388306,
2.635507345199585,
-0.689411461353302,
-4.14346981048584,
-0.019858945161104202,
1.217101812362671,
0.9154455661773682,
-1.731... |
[H:19][C:6]1([C:7](=[S:23])[N:21]([C:5]1([H:17])[H:18])[S:22][H:16])[H:20].[H:13][C@@:3]([C:2]([H:11])([H:12])[C:1]([H:8])([H:9])[H:10])([C:4]([H:14])([H:15])[Cl:25])[Cl:24] | [
-3.95278000831604,
1.8115259408950806,
0.3427020013332367,
-2.680922031402588,
1.1952519416809082,
-0.37262099981307983,
-2.2326838970184326,
-0.08984100073575974,
0.3470720052719116,
-0.9302170276641846,
-0.827049970626831,
-0.2509480118751526,
3.429028034210205,
-0.9354060292243958,
0.... | [
-1283587.375
] | [
-3.8187801837921143,
22.014448165893555,
19.058181762695312,
-7.521346092224121,
25.4609375,
-6.492350101470947,
31.036134719848633,
-19.350942611694336,
-29.661823272705078,
-64.82124328613281,
19.597196578979492,
94.63346099853516,
9.516362190246582,
14.23624038696289,
-4.0282874107360... |
[H:18][C:7](=[C:6]([H:17])[C@@:5]([H:16])([F:22])[Cl:23])[H:19].[H:11][C:2]1([C:3]([C:4]([N:20]1[C:1]([H:8])([H:9])[H:10])([H:14])[H:15])([H:13])[F:21])[H:12] | [
0.7382919788360596,
0.5258920192718506,
1.6519060134887695,
-0.9960539937019348,
0.8912789821624756,
-0.09898100048303604,
-2.218648910522461,
-0.006984000094234943,
0.10976599901914597,
-1.4231319427490234,
-0.6461160182952881,
1.2519910335540771,
0.9951350092887878,
-0.045292001217603683... | [
-620046.1875
] | [
-6.795109272003174,
-15.924989700317383,
70.46637725830078,
-167.0634765625,
-19.94418716430664,
37.39408874511719,
-18.444965362548828,
-12.142459869384766,
22.65943145751953,
-12.491734504699707,
-8.655830383300781,
6.292635440826416,
32.10832977294922,
-25.61482810974121,
-12.18632316... |
[H:8][C:3]\1=[N:11][O:15][N:10](/[C:4]1=[N:12]/[H:9])[S:18][H:7].[H:5][O:13][C:1](=[O:14])[C:2](=[S:17])[S:16][H:6] | [
-3.1236650943756104,
0.3226659893989563,
-0.19753000140190125,
-1.6171849966049194,
0.17700999975204468,
0.02324100024998188,
3.4804160594940186,
0.9904590249061584,
0.08508100360631943,
2.255260944366455,
0.5317829847335815,
0.7515010237693787,
-4.43921422958374,
1.5247180461883545,
-0.... | [
-1091601.875
] | [
-7.229105472564697,
-12.955928802490234,
14.203045845031738,
-54.386375427246094,
33.35395050048828,
23.117502212524414,
-0.14833198487758636,
-1.0378661155700684,
-2.981868028640747,
8.729632377624512,
-18.758358001708984,
-12.799717903137207,
2.186595916748047,
0.4512642025947571,
-0.1... |
[H:17][C:5](=[S:26])[N:22]([H:16])[O:23][C:4]([H:14])([H:15])[C:3]([H:12])([H:13])[F:24].[H:8][C:1](=[S:25])[N:19](/[C:2](=[N:21]\[H:11])/[N:20]([H:9])[H:10])[N:18]([H:6])[H:7] | [
-2.0910470485687256,
1.4855999946594238,
-0.2662689983844757,
-2.359683036804199,
-0.9785109758377075,
0.06366799771785736,
1.7784160375595093,
1.555907964706421,
0.7777699828147888,
2.8249800205230713,
0.8026350140571594,
1.5671910047531128,
2.3989319801330566,
-1.413912057876587,
-0.84... | [
-905399
] | [
3.4794704914093018,
1.8381589651107788,
-5.965492248535156,
-2.714970350265503,
-0.5056708455085754,
-4.89810037612915,
0.8388901352882385,
-1.604898452758789,
7.958156585693359,
1.980755090713501,
2.343364953994751,
-1.9014166593551636,
-0.4089979827404022,
-0.3515188694000244,
0.076877... |
[H:5][C:1]([H:6])([H:7])[C:2]([C:3]([H:8])([H:9])[H:10])([C:4]([H:11])([H:12])[H:13])[F:14].[F:15][F:16] | [
-1.2478530406951904,
1.5265189409255981,
-0.2899149954319,
-1.204733967781067,
0.04449800029397011,
-0.015099000185728073,
0.30005499720573425,
-0.42362600564956665,
-0.025018999353051186,
-2.035120964050293,
-0.3570230007171631,
1.1768440008163452,
-0.8360009789466858,
1.9218980073928833,... | [
-286862.09375
] | [
-18.75499153137207,
32.89234161376953,
-9.029487609863281,
16.655162811279297,
-36.71369552612305,
-5.807601451873779,
-77.12679290771484,
-1.2645844221115112,
-21.988887786865234,
-56.4505729675293,
120.16778564453125,
-19.86104965209961,
-3.05289626121521,
8.490406036376953,
-5.4348077... |
[H:5]/[C:1](=[C-:2]/[F:9])/[F:8].[H:6][C@@:3]([C:4]#[N+:7][Cl:11])([F:10])[Cl:12] | [
-3.519670009613037,
0.46564099192619324,
-0.21010899543762207,
-2.326077938079834,
-0.07140299677848816,
-0.006417000200599432,
2.5530450344085693,
0.11413300037384033,
0.6083679795265198,
1.197090983390808,
-0.23084600269794464,
0.1492539942264557,
-3.6773619651794434,
1.4505139589309692,... | [
-896105.625
] | [
3.250030755996704,
2.002762794494629,
-2.077047348022461,
-20.29891014099121,
-6.843364715576172,
0.7938419580459595,
-59.524139404296875,
-24.855098724365234,
-10.282735824584961,
179.70762634277344,
-3.01682710647583,
59.983402252197266,
1.0223710536956787,
-3.8241162300109863,
1.10565... |
[H:8]/[C:2](=[C:1](/[H:7])\[F:15])/[C@:3]([H:9])([F:16])[Cl:18].[H:13]/[C:5](=[C:6](/[H:14])\[Cl:19])/[C:4]([H:11])([H:12])[S:17][H:10] | [
2.7180309295654297,
-1.9019110202789307,
-0.16661599278450012,
2.109389066696167,
-0.6596860289573669,
-0.3339729905128479,
1.2304209470748901,
-0.11767899990081787,
0.855309009552002,
-0.5128740072250366,
0.9285249710083008,
-0.6355530023574829,
-1.4628269672393799,
0.13412199914455414,
... | [
-1098952.5
] | [
-22.342214584350586,
20.376243591308594,
-10.612711906433105,
7.288244724273682,
-68.7333984375,
53.00672149658203,
132.7283172607422,
-54.93937301635742,
54.55379867553711,
-22.985939025878906,
104.45802307128906,
-174.5604248046875,
-261.5465393066406,
20.9266300201416,
-64.54478454589... |
[H:6][C:3](=[C:4]([F:9])[F:10])[F:8].[H:5][C:1]([C:2]#[N:7])([Cl:11])[Cl:12] | [
1.5373929738998413,
-0.017163999378681183,
0.04031899943947792,
2.0148069858551025,
-0.7980089783668518,
1.222303032875061,
-1.7600350379943848,
-0.3408310115337372,
-0.36366599798202515,
-2.9688379764556885,
-0.16114799678325653,
0.13325299322605133,
0.4950670003890991,
0.0813829973340034... | [
-896249.3125
] | [
23.4993839263916,
-33.727439880371094,
42.207889556884766,
-16.514915466308594,
22.6314697265625,
-20.840112686157227,
-25.682769775390625,
11.861115455627441,
-7.145667552947998,
-58.290565490722656,
37.361995697021484,
-7.831702709197998,
-22.201234817504883,
-3.582716464996338,
-0.795... |
[H:23][C:9]#[C:8][C:7]([H:21])([H:22])[C@:6]([H:19])([C:5]([H:16])([H:17])[H:18])[S:26][H:20].[H:13][C:3](=[C:2]([C:4](=[S:25])[S:24][H:15])[C:1]([H:10])([H:11])[H:12])[H:14] | [
0.37101998925209045,
1.4072049856185913,
0.591530978679657,
1.7463150024414062,
1.1341849565505981,
0.02459299936890602,
2.5232250690460205,
2.0909149646759033,
-0.5135359764099121,
2.323380947113037,
-0.28433799743652344,
0.16233199834823608,
-1.4977350234985352,
-1.2285350561141968,
0.... | [
-969916.875
] | [
65.16178131103516,
74.04244995117188,
17.765750885009766,
8.746417045593262,
-31.114057540893555,
-10.71021556854248,
28.317626953125,
-24.4766902923584,
19.175159454345703,
15.662261009216309,
31.532886505126953,
-27.1324405670166,
72.50821685791016,
18.847902297973633,
-26.700586318969... |
[H:8][C@@:2]1([C:6](=[S:17])[C:5]([C:4]([C:3]1([H:9])[H:10])([H:11])[H:12])([H:13])[H:14])[F:16].[H:7][C:1]([F:15])([Cl:18])[Cl:19] | [
-3.270601987838745,
-0.05040600150823593,
-0.5476199984550476,
1.4865130186080933,
-0.5497180223464966,
0.5960569977760315,
1.8509429693222046,
-1.7822309732437134,
-0.2134770005941391,
3.344731092453003,
-1.5762569904327393,
-0.5068939924240112,
3.445317029953003,
-0.07130099833011627,
... | [
-1099210.125
] | [
-2.8351569175720215,
5.649832248687744,
1.4588409662246704,
-2.233433485031128,
0.7784950733184814,
-6.62758207321167,
-0.3932977020740509,
-0.07753965258598328,
-0.2789655923843384,
0.89765465259552,
-0.28940317034721375,
0.9246819019317627,
1.0253664255142212,
0.5792759656906128,
-0.21... |
[H:14][C@@:4]1([C:3]([O:20][C@@:2]([C:5]1([O:22][H:16])[O:23][H:17])([C:1]([H:8])([H:9])[H:10])[O:19][H:11])([H:12])[H:13])[O:21][H:15].[H:6][O:18][H:7] | [
-0.8030620217323303,
-2.192483901977539,
-0.8793209791183472,
-0.23713399469852448,
-1.0357789993286133,
-0.08826000243425369,
0.8706480264663696,
0.9136859774589539,
-0.8225849866867065,
-0.6161699891090393,
1.2168610095977783,
-0.7697209715843201,
-1.1794209480285645,
0.13422399759292603... | [
-407334.28125
] | [
27.350845336914062,
9.399145126342773,
-23.3713321685791,
0.6561633944511414,
-35.76531982421875,
-22.47304916381836,
-28.360383987426758,
-23.586959838867188,
-48.17629623413086,
-8.814745903015137,
34.50019454956055,
67.16988372802734,
-9.718209266662598,
7.27338981628418,
46.979034423... |
[H:13]/[C:3](=[N:24]\[H:14])/[N:23]([H:12])[S:28][C:2]([H:10])([H:11])[C:1]([H:7])([H:8])[H:9].[H:15][C:4]([H:16])([H:17])[N:25]([H:18])[N:26]([H:19])/[C:5](=[N:27]/[H:20])/[C:6]([H:21])([H:22])[Cl:29] | [
2.972338914871216,
-2.5200719833374023,
-0.9297419786453247,
2.2766480445861816,
-1.221182942390442,
-1.309095025062561,
3.5480899810791016,
0.7391480207443237,
1.0540430545806885,
-4.578187942504883,
-1.437788963317871,
0.5615910291671753,
-1.8265949487686157,
0.07834800332784653,
0.413... | [
-859886.875
] | [
-0.31188514828681946,
-1.2366726398468018,
0.8714385628700256,
3.410360813140869,
0.027835963293910027,
-1.1707539558410645,
1.6883091926574707,
0.9279891848564148,
-1.129492163658142,
-3.5502769947052,
-1.0573159456253052,
2.1210803985595703,
-1.1209399700164795,
-1.2922816276550293,
4.... |
[H:14][C@@:4]1([C:3]([O:20][C@@:2]([C:5]1([O:22][H:16])[O:23][H:17])([C:1]([H:8])([H:9])[H:10])[O:19][H:11])([H:12])[H:13])[O:21][H:15].[H:6][O:18][H:7] | [
2.1463029384613037,
-1.1972039937973022,
-0.9191290140151978,
1.3639030456542969,
-0.3652369976043701,
0.07066900283098221,
0.7973719835281372,
1.924649953842163,
0.02280299924314022,
-0.3167159855365753,
1.1564960479736328,
-0.6657350063323975,
-0.13336899876594543,
-0.27486300468444824,
... | [
-407335.84375
] | [
16.423072814941406,
32.43208694458008,
-6.31511116027832,
33.877098083496094,
-12.337121963500977,
-20.708858489990234,
16.969730377197266,
-15.354585647583008,
-56.13106918334961,
-45.287559509277344,
-11.408031463623047,
51.95352554321289,
-26.183683395385742,
-26.461811065673828,
28.0... |
[H:6][C:3]1=[C:2]([N:10]([N:9]=[N:8]1)[H:7])[Cl:14].[H:4][S:12][C:1](=[O:11])[S:13][H:5] | [
-3.43353009223938,
-0.3127390146255493,
-0.13312500715255737,
3.576306104660034,
-0.1976969987154007,
0.03763199970126152,
2.3456249237060547,
0.4686860144138336,
0.20027899742126465,
-4.867694854736328,
1.378909945487976,
1.0631229877471924,
-5.7819671630859375,
0.45373600721359253,
-0.... | [
-1011996.1875
] | [
-10.694286346435547,
49.80474853515625,
49.082489013671875,
-32.081451416015625,
18.58062171936035,
-10.11884880065918,
30.455259323120117,
-20.295454025268555,
4.132636070251465,
48.2003288269043,
-13.79114818572998,
-6.362551212310791,
42.73193359375,
-41.51415252685547,
4.865820884704... |
[H:3][C:1]([H:4])([H:5])[O:6][S:13](=[O:7])(=[O:8])[C:2]([F:10])([F:11])[F:12].[O:9]=[S:14] | [
1.5983699560165405,
2.6338698863983154,
0.7379890084266663,
0.8156769871711731,
-1.2921479940414429,
0.2599579989910126,
1.4730160236358643,
3.1166179180145264,
1.7696889638900757,
2.6685030460357666,
2.6274030208587646,
0.4653719961643219,
1.053846001625061,
3.1427409648895264,
-0.05391... | [
-925453.625
] | [
20.320632934570312,
9.20067310333252,
23.322120666503906,
-3.2469000816345215,
11.309083938598633,
29.804330825805664,
-0.624660849571228,
-20.339481353759766,
-38.70418167114258,
-9.489145278930664,
2.2650249004364014,
6.0541181564331055,
-6.642958641052246,
0.3836759626865387,
5.217739... |
[H:13][C:4]1=[C:3]([S:20][C@:2]2([C@@:5]1([C@@:1]2([H:10])[S:19][H:9])[H:14])[H:11])[H:12].[H:16]/[C:7](=[C:6](/[H:15])\[F:18])/[C:8](=[S:21])[H:17] | [
3.178666114807129,
1.1945890188217163,
0.6994460225105286,
3.4520769119262695,
0.9771999716758728,
-0.764805018901825,
2.219759941101074,
-1.2384920120239258,
-0.9517920017242432,
1.412358045578003,
-0.31542301177978516,
-0.42669400572776794,
2.018723964691162,
1.0291670560836792,
-0.269... | [
-1006876.6875
] | [
2.0252792835235596,
-0.5605696439743042,
2.003697156906128,
2.8634934425354004,
0.3938668966293335,
-2.679352045059204,
-0.3158469796180725,
1.7976881265640259,
1.7537522315979004,
2.809518337249756,
-1.2612831592559814,
-0.9885953068733215,
-3.999610662460327,
-0.3594757318496704,
-1.30... |
[H:13][C:7]#[C:6]/[C:5](=[C:4](\[H:11])/[C:3](=[S:15])[H:10])/[H:12].[H:8][C:2](=[C:1]([F:14])[Cl:16])[H:9] | [
-2.030776023864746,
0.10302600264549255,
0.5461959838867188,
-3.0134470462799072,
-0.5897480249404907,
1.0915700197219849,
3.1337549686431885,
-0.6240540146827698,
0.1504340022802353,
1.8253639936447144,
-1.2067140340805054,
-0.13082200288772583,
0.7392060160636902,
-0.47695499658584595,
... | [
-770754.1875
] | [
-52.82136917114258,
32.482791900634766,
29.413814544677734,
5.344712257385254,
11.613194465637207,
11.574553489685059,
0.9869280457496643,
0.3971504271030426,
3.2654120922088623,
-0.8603629469871521,
2.6464810371398926,
-0.9752464890480042,
69.65872192382812,
-20.564374923706055,
-59.744... |
[H:10][C@@:2]([C:1]([H:8])([H:9])[N:21]([H:6])[H:7])([C:3]([H:11])([H:12])[O:25][H:13])[F:26].[H:16][C:4]([H:17])(/[C:5](=[N:23]/[H:18])/[N:24]([H:19])[S:27][H:20])[N:22]([H:14])[H:15] | [
3.2434709072113037,
0.14721199870109558,
-0.7335820198059082,
2.2319769859313965,
-0.3876729905605316,
0.25582900643348694,
1.0565470457077026,
-1.1158560514450073,
-0.3634819984436035,
-1.9720669984817505,
-1.7373360395431519,
0.13375499844551086,
-1.932399034500122,
-0.269773006439209,
... | [
-622334.75
] | [
-3.5451886653900146,
-4.212297439575195,
-3.686915636062622,
4.290860176086426,
-1.9388399124145508,
-3.4480082988739014,
26.171369552612305,
9.230803489685059,
9.789823532104492,
-35.3497428894043,
-12.444755554199219,
0.7386847138404846,
-26.151594161987305,
-3.8565640449523926,
-12.59... |
[H:12][C:4]#[C:3][C@@:1]([H:10])([C:2](=[S:20])[H:11])[S:19][H:9].[H:17][C:8]#[C:7][C@@:5]([H:14])([C:6]([H:15])([H:16])[F:18])[S:21][H:13] | [
-2.8197999000549316,
-0.3791640102863312,
0.13472500443458557,
-2.039828062057495,
0.8909429907798767,
0.38575300574302673,
-2.7063260078430176,
-1.2867239713668823,
1.2742340564727783,
-2.575670003890991,
-2.0144739151000977,
2.224936008453369,
2.370893955230713,
-0.1359339952468872,
0.... | [
-1006822.25
] | [
-2.9782962799072266,
2.1957337856292725,
2.0610673427581787,
0.23464196920394897,
4.1656646728515625,
-0.6436494588851929,
1.6006734371185303,
-8.998998641967773,
9.447737693786621,
-0.9591074585914612,
7.229205131530762,
-9.516419410705566,
-0.14869721233844757,
-1.7792450189590454,
3.4... |
[H:27][C:8]1([C:9]([N:31]1[C:7]([H:25])([H:26])[C:6]([H:23])([H:24])[S:33][H:22])([H:29])[H:30])[H:28].[H:10][C:1]([H:11])([H:12])[C:2]([H:13])([C:3]([H:14])([H:15])[H:16])[C:4]([H:17])([H:18])[C:5]([H:19])([H:20])[S:32][H:21] | [
-1.2111469507217407,
0.629643976688385,
1.3555020093917847,
-2.146955966949463,
-0.5297510027885437,
0.8059549927711487,
-1.4391499757766724,
-1.425523042678833,
-0.31927698850631714,
-3.4839529991149902,
0.12483499944210052,
0.2756739854812622,
-4.466957092285156,
-0.896602988243103,
-0... | [
-757067.25
] | [
-2.686871290206909,
-69.67537689208984,
-8.536770820617676,
22.929140090942383,
34.18490219116211,
-29.689533233642578,
42.77788543701172,
50.98192596435547,
5.355693340301514,
79.03567504882812,
-15.735947608947754,
31.157323837280273,
-38.19020080566406,
-5.029946804046631,
-15.7494239... |
[H:14][C:4](=[S:20])[N:16]([H:13])[N:15]([H:11])[H:12].[H:5][C:1]([H:6])([H:7])[O:17][C:2]([H:8])([H:9])[C:3]([H:10])([F:18])[F:19] | [
4.7730631828308105,
0.2697789967060089,
-1.0835310220718384,
3.7568459510803223,
-0.35062700510025024,
0.9614580273628235,
2.3605570793151855,
0.21991799771785736,
0.7889860272407532,
-4.107998847961426,
0.3691689968109131,
-0.21211400628089905,
5.432528972625732,
-0.1828020066022873,
-1... | [
-590499.5625
] | [
5.046841144561768,
4.8236236572265625,
-4.607384204864502,
1.2450634241104126,
-1.8344354629516602,
4.059513568878174,
7.036538600921631,
3.1515257358551025,
7.061647415161133,
-0.8911966681480408,
-1.9529974460601807,
0.5778707265853882,
-2.139863967895508,
1.541232943534851,
2.11319351... |
[H:17][C:6](=[C:5]([C:4]([H:14])([H:15])[H:16])[C:7]([H:19])([F:21])[F:22])[H:18].[H:12][C:3](=[C:2]([C:1]([H:10])([H:11])[N:20]([H:8])[H:9])[Cl:23])[H:13] | [
-1.5100059509277344,
-0.6317909955978394,
0.9167050123214722,
-2.612973928451538,
0.24670599400997162,
0.38172900676727295,
-2.4272170066833496,
1.5854949951171875,
0.24977099895477295,
1.6224490404129028,
-0.003333000000566244,
1.5097299814224243,
1.7565540075302124,
0.32659199833869934,
... | [
-620271.875
] | [
-95.90296936035156,
28.939804077148438,
81.77256774902344,
39.046485900878906,
92.3392105102539,
2.274651288986206,
-59.781429290771484,
-36.694801330566406,
2.7237930297851562,
40.648990631103516,
-29.441116333007812,
48.344749450683594,
55.10103988647461,
2.898300886154175,
12.95355224... |
[H:6]/[C:2](=[C:3](/[F:7])\[Cl:11])/[C:1](=[S:9])[S:8][H:5].[H:4][Cl:10] | [
-2.016484022140503,
-0.16881699860095978,
-0.11943300068378448,
-0.8284770250320435,
0.667631983757019,
-0.2940079867839813,
0.21579399704933167,
0.7368029952049255,
0.542805016040802,
4.97370719909668,
-2.147922992706299,
-0.8409460186958313,
-4.054121017456055,
-0.7819939851760864,
-1.... | [
-1212787.625
] | [
-1.6884478330612183,
-2.6810169219970703,
2.623248338699341,
4.1348395347595215,
-0.006754436530172825,
3.4269931316375732,
-4.551829814910889,
2.073169708251953,
-7.334585189819336,
-0.012515155598521233,
-0.1088239848613739,
-0.014207322150468826,
0.71940678358078,
-0.08858557790517807,
... |
[H:10][C:2](=[C:1]([H:9])[Cl:28])[N:25]([H:11])/[C:3](=[N:26]/[H:13])/[H:12].[H:21][C@:7]([C:8]([H:22])([H:23])[H:24])([C:5]([H:17])([C:4]([H:14])([H:15])[H:16])[C:6]([H:18])([H:19])[H:20])[F:27] | [
-3.530618906021118,
-0.5156919956207275,
-0.05905099958181381,
-3.7895541191101074,
0.7915610074996948,
-0.048190999776124954,
-1.542428970336914,
1.7075790166854858,
0.4675849974155426,
5.084412097930908,
-1.0561230182647705,
-0.5687260031700134,
3.65175199508667,
-0.8757740259170532,
-... | [
-617443.4375
] | [
-0.03802097961306572,
4.292543888092041,
0.3289099931716919,
-0.2752302587032318,
-3.958064317703247,
-0.2730839252471924,
-3.1033363342285156,
-7.588709354400635,
0.1973229944705963,
1.5994958877563477,
-0.09187860041856766,
0.09774011373519897,
-1.0489856004714966,
-1.0976754426956177,
... |
[H:23][C:9]#[C:8][C@@:6]([H:19])([C:5]([H:16])([H:17])[H:18])[C:7]([H:20])([H:21])[S:26][H:22].[H:13][C:3](=[C:2]([C:4](=[S:25])[H:15])[C:1]([H:11])([H:12])[S:24][H:10])[H:14] | [
1.8165409564971924,
0.3353149890899658,
1.2401889562606812,
3.2297780513763428,
0.4219740033149719,
0.5928429961204529,
3.922434091567993,
1.6450810432434082,
0.6568679809570312,
3.756247043609619,
-0.6402940154075623,
-0.16384999454021454,
-4.605093002319336,
-1.337231993675232,
0.53489... | [
-969928.125
] | [
13.51048469543457,
-25.369098663330078,
29.66645050048828,
-2.7074925899505615,
94.0660400390625,
29.449941635131836,
-33.01799011230469,
-70.65681457519531,
-27.995656967163086,
19.915863037109375,
-33.91016387939453,
-51.47075271606445,
-22.488750457763672,
-0.12932327389717102,
51.047... |
[H:10][C:3]1=[N:15][N:16]=[C:4]([C:1]1([C:2]([H:8])([H:9])[F:22])[O:20][H:7])[H:11].[H:14][N:19]1[C:6](=[O:21])[N:18]=[C:5]([S:23]1)[N:17]([H:12])[H:13] | [
-3.3182179927825928,
-0.2196040004491806,
-0.18387700617313385,
-4.705891132354736,
-0.06478899717330933,
-0.6216890215873718,
-2.5375349521636963,
1.1518570184707642,
-0.6646909713745117,
-3.1830389499664307,
0.05150099843740463,
1.298632025718689,
4.0106730461120605,
-0.8973100185394287,... | [
-725171.5
] | [
2.8266072273254395,
43.09107971191406,
13.88185977935791,
-81.47032928466797,
53.748592376708984,
-61.499717712402344,
-22.88438606262207,
-75.44606018066406,
10.533365249633789,
62.76506042480469,
79.18144226074219,
-27.407184600830078,
4.268309593200684,
3.840852975845337,
-3.674445629... |
[H:22][C@@:6]([C:7]([H:23])([H:24])[H:25])([C:5]([H:20])([H:21])[C:4]([H:17])([H:18])[H:19])[F:27].[H:11][C@:2]([C:1]([H:8])([H:9])[H:10])([C:3]([H:13])([H:14])[N:26]([H:15])[H:16])[S:28][H:12] | [
1.7810159921646118,
1.9373799562454224,
0.42177000641822815,
1.3140350580215454,
0.6045740246772766,
-0.15356700122356415,
2.365447998046875,
-0.029562000185251236,
-1.0715689659118652,
-3.3265628814697266,
1.4630860090255737,
-0.09861499816179276,
-2.109349012374878,
0.7382699847221375,
... | [
-521014.4375
] | [
0.8535836338996887,
0.38030704855918884,
0.4739264249801636,
8.259537696838379,
5.100255489349365,
-1.9213004112243652,
-2.9382107257843018,
3.1488564014434814,
-2.132763147354126,
-2.2592334747314453,
0.3192088007926941,
0.04521891474723816,
-1.4874322414398193,
1.6622862815856934,
3.33... |
[H:5][C:3](=[C:2]([H:4])[C:1]([F:7])([Cl:10])[Cl:11])[H:6].[S:8]=[S:9] | [
0.9608529806137085,
-0.11344599723815918,
-0.10666000097990036,
-0.07104399800300598,
-0.44220900535583496,
0.8812789916992188,
-0.5099020004272461,
0.33240100741386414,
1.8638689517974854,
-0.5976859927177429,
-1.4240800142288208,
0.7243419885635376,
-1.4670759439468384,
0.029973000288009... | [
-1212730.75
] | [
32.296871185302734,
-6.309463024139404,
-22.913578033447266,
-7.374488353729248,
-25.14564323425293,
-2.948967456817627,
-8.443319320678711,
16.924816131591797,
6.756282806396484,
28.792692184448242,
25.57457160949707,
-1.4231891632080078,
21.281713485717773,
8.247129440307617,
13.007629... |
[H:9][C:3]#[C:2][C:1]([H:8])([F:21])[F:22].[H:13][C@@:5]([C:4]([H:10])([H:11])[H:12])([C:6]([H:14])([H:15])[C:7]([H:16])([H:17])[N:20]([H:18])[H:19])[Cl:23] | [
-2.7014219760894775,
-0.3467260003089905,
0.2906019985675812,
-1.5105129480361938,
-0.4515190124511719,
1.148337960243225,
-0.593737006187439,
-0.6303480267524719,
1.8982739448547363,
1.9090509414672852,
-1.840893030166626,
-0.894635021686554,
1.4800540208816528,
-0.513034999370575,
-0.3... | [
-620281.625
] | [
-6.2593255043029785,
7.843703269958496,
38.978538513183594,
-11.861749649047852,
0.0738944411277771,
12.601968765258789,
33.855430603027344,
-30.461957931518555,
27.371944427490234,
-8.006139755249023,
-9.068474769592285,
-9.844435691833496,
-10.135437965393066,
10.593299865722656,
-6.00... |
[H:12]/[C:5](=[C:4](\[C:3]([H:9])([H:10])[H:11])/[C:6]([H:13])([Cl:18])[Cl:19])/[Cl:17].[H:8][C:2](=[O:14])[C@@:1]([H:7])([F:15])[Cl:16] | [
2.1502110958099365,
0.04797400161623955,
-0.37987399101257324,
2.547420024871826,
1.1510330438613892,
0.6006119847297668,
-0.6195639967918396,
2.162621021270752,
1.1576240062713623,
-1.3695909976959229,
1.062824010848999,
0.45190000534057617,
-2.4940950870513916,
1.3317279815673828,
-0.2... | [
-1411025
] | [
42.31687927246094,
28.286455154418945,
28.653593063354492,
13.580541610717773,
-3.335556983947754,
-12.683869361877441,
0.2744653820991516,
1.018406867980957,
0.01646038144826889,
-3.7855937480926514,
1.399444341659546,
-2.6085572242736816,
2.916595697402954,
0.4149235188961029,
1.814213... |
[H:11][C:2](=[C:3]([C:4]([H:12])([H:13])[H:14])[Cl:23])[C:1]([H:8])([H:9])[H:10].[H:16][C@@:6]1([C:7]([N:20]1[H:19])([H:17])[H:18])[C:5]([H:15])([F:21])[F:22] | [
-2.274211883544922,
1.9908100366592407,
0.6353480219841003,
-3.169358015060425,
0.905951976776123,
0.22666999697685242,
-2.793297052383423,
-0.37244701385498047,
-0.12752899527549744,
-3.7832860946655273,
-1.414473056793213,
-0.3347179889678955,
1.7867050170898438,
0.528814971446991,
-0.... | [
-620254.625
] | [
-26.607576370239258,
27.83782386779785,
-18.241056442260742,
-7.9399590492248535,
-55.78849411010742,
-50.769866943359375,
15.792243957519531,
66.3959732055664,
52.48506546020508,
9.745311737060547,
-49.861019134521484,
-2.3543076515197754,
0.06126544252038002,
-16.4821720123291,
-5.6056... |
[H:5][C:1]([H:6])([H:7])[C:2]([H:8])([H:9])[F:14].[H:10][C:3]([H:11])([H:12])[C:4]([H:13])([F:15])[F:16] | [
2.756714105606079,
-0.8970149755477905,
0.27299898862838745,
1.849593997001648,
0.08929499983787537,
-0.42767098546028137,
-1.4692280292510986,
1.2729699611663818,
-0.19339799880981445,
-1.929960012435913,
-0.1577800065279007,
-0.2164199948310852,
3.739274024963379,
-0.4517880082130432,
... | [
-287022.3125
] | [
2.237368106842041,
0.871465802192688,
2.178215742111206,
3.35660982131958,
-15.639511108398438,
-8.015326499938965,
2.4423952102661133,
0.625852644443512,
1.2938908338546753,
-10.58727741241455,
14.898209571838379,
0.17508529126644135,
-2.6972815990448,
-1.6400331258773804,
-0.7225041389... |
[H:17][C@@:4]1([C@@:2]([C:3]1([H:15])[H:16])([C:1]([H:11])([H:12])[N:25]([H:9])[H:10])[N:26]([H:13])[H:14])[Cl:28].[H:21][C:7]1([C:8]([C:6]1([H:20])[C:5]([H:18])([H:19])[F:27])([H:23])[H:24])[H:22] | [
-1.087054967880249,
-1.7680939435958862,
0.23463000357151031,
-1.9492369890213013,
-0.5619909763336182,
0.5670199990272522,
-3.3324460983276367,
-0.7818549871444702,
1.1147700548171997,
-3.1608150005340576,
-0.36007800698280334,
-0.3112579882144928,
3.543879985809326,
1.486994981765747,
... | [
-617423.8125
] | [
-4.6892619132995605,
-0.45715534687042236,
2.6080710887908936,
-1.067282795906067,
-1.484925389289856,
-0.8482344150543213,
-1.7276606559753418,
-3.338712215423584,
2.2427384853363037,
-0.2748875319957733,
-2.7793498039245605,
-3.1049609184265137,
9.223113059997559,
-3.3667261600494385,
... |
[H:10][C:4](=[C:3](/[C:2](=[C:1](/[H:8])\[F:21])/[H:9])[F:22])[H:11].[H:16][C:6]([H:17])([C:5]([H:14])([H:15])[N:20]([H:12])[H:13])[C:7]([H:18])([H:19])[Cl:23] | [
1.9946620464324951,
-1.2088110446929932,
-0.20218099653720856,
1.9510159492492676,
0.10403899848461151,
-0.003998999949544668,
3.081876039505005,
1.034024953842163,
-0.012799999676644802,
4.373260021209717,
0.7982689738273621,
-0.21342900395393372,
-4.401636123657227,
0.38054999709129333,
... | [
-620298.5
] | [
15.295025825500488,
2.973375082015991,
-3.503533124923706,
22.226665496826172,
12.813698768615723,
-2.4810802936553955,
7.0544352531433105,
-12.990950584411621,
-3.197152614593506,
-1.930441975593567,
2.8933119773864746,
0.7577301859855652,
3.274197816848755,
-1.7295353412628174,
4.73344... |
[H:13][C:5]#[C:4]/[C:2](=[C:3](\[H:12])/[Cl:21])/[S-:19]([C:1]([H:9])([H:10])[H:11])[N+:17]#[C:8][C:7](=[S:20])[O:18][N:16]=[C:6]([H:14])[H:15] | [
-0.3947179913520813,
-1.1104029417037964,
2.063947916030884,
-2.209023952484131,
0.25852900743484497,
0.46307599544525146,
-3.009394884109497,
0.5682910084724426,
-0.5658789873123169,
-2.1416850090026855,
1.1619709730148315,
1.5706570148468018,
-2.075347900390625,
1.9145020246505737,
2.5... | [
-1098155.875
] | [
-18.607913970947266,
-10.294422149658203,
21.89084243774414,
-2.4446542263031006,
8.949047088623047,
7.21344518661499,
2.834592580795288,
-9.346626281738281,
-9.797857284545898,
6.225030422210693,
5.024190902709961,
10.8920259475708,
-1.429560661315918,
-5.955255031585693,
-7.84097814559... |
[H:7][C:3](=[S:17])/[C:2](=[C:1](/[F:15])\[Cl:18])/[Cl:19].[H:8][C:4]([H:9])([H:10])[C:5]([H:11])([C:6]([H:12])([H:13])[H:14])[F:16] | [
2.3805840015411377,
-0.21209700405597687,
0.2500939965248108,
1.4465579986572266,
0.606997013092041,
-0.27370399236679077,
0.13053199648857117,
0.27222898602485657,
-0.8080980181694031,
-3.799015998840332,
0.88987797498703,
1.5131109952926636,
-3.1945369243621826,
0.38052898645401,
0.220... | [
-1099179.875
] | [
-11.4362154006958,
6.392501354217529,
-5.265063285827637,
4.357504367828369,
-9.797386169433594,
9.842416763305664,
-1.616319179534912,
-10.442222595214844,
-7.386086940765381,
0.7168228626251221,
-0.5550034046173096,
1.959786295890808,
-13.223980903625488,
10.083369255065918,
-4.1748061... |
[H:5][C:4](=[C:3]([F:10])[Cl:12])[H:6].[C:2](#[N:7])[C:1]([F:8])([F:9])[Cl:11] | [
-1.2374199628829956,
-0.2001740038394928,
0.4619959890842438,
-1.7669440507888794,
1.111881971359253,
0.000514000013936311,
2.321429967880249,
-0.04078799858689308,
0.060127001255750656,
2.961529016494751,
0.15890799462795258,
1.2358490228652954,
3.4836440086364746,
-0.6240900158882141,
... | [
-896200.75
] | [
-16.203887939453125,
68.14869689941406,
-4.931613922119141,
-179.17926025390625,
135.65774536132812,
-72.01781463623047,
28.129392623901367,
-35.466880798339844,
0.6082526445388794,
-32.73706817626953,
-43.63602828979492,
-75.64779663085938,
5.460448741912842,
-2.62781023979187,
-2.32247... |
[H:18]/[C:6](=[C:7](/[H:19])\[Cl:23])/[F:22].[H:11][C@:2]1([C@@:3]([N:20]1[C:5]([H:15])([H:16])[H:17])([H:12])[C:4]([H:13])([H:14])[F:21])[C:1]([H:8])([H:9])[H:10] | [
3.5094850063323975,
-2.0053610801696777,
-0.3821299970149994,
2.807969093322754,
-0.7726569771766663,
0.12821200489997864,
1.4838509559631348,
-0.3382929861545563,
-0.3839069902896881,
0.44994300603866577,
0.2664630115032196,
0.5364469885826111,
2.940999984741211,
1.6884880065917969,
-0.... | [
-620303.875
] | [
-0.6617260575294495,
-0.5338423848152161,
-1.749830722808838,
1.970596194267273,
-3.09222412109375,
1.6872478723526,
-4.125413417816162,
-1.7486248016357422,
1.2662540674209595,
-1.5506032705307007,
-2.0615901947021484,
-7.403782844543457,
0.7009115219116211,
3.447462797164917,
0.1960529... |
[H:11]/[C:4](=[C:2](\[C:1]([H:7])([H:8])[H:9])/[S:18][C:3](=[S:19])[H:10])/[Cl:21].[H:12][C:5](=[O:16])[N:15]([H:13])[S:20][C:6](=[O:17])[H:14] | [
2.232167959213257,
1.9122079610824585,
1.4372669458389282,
2.6237499713897705,
0.9630680084228516,
0.3401539921760559,
0.3217700123786926,
-0.41178399324417114,
-0.28535500168800354,
3.8148889541625977,
0.36716601252555847,
0.31209900975227356,
-3.3521440029144287,
1.4171600341796875,
-0... | [
-1313597.375
] | [
-0.7016775608062744,
1.4531834125518799,
1.0987437963485718,
5.057623863220215,
-3.407147169113159,
1.0313950777053833,
22.60266876220703,
1.2332206964492798,
-3.96152925491333,
-4.347043037414551,
2.521665096282959,
0.9027276039123535,
-6.861229419708252,
-2.7245826721191406,
8.05465030... |
[H:9]/[C:2](=[C:3](\[H:10])/[F:17])/[O:14][C:1]([H:6])([H:7])[H:8].[H:12][C:5]([H:13])([C:4](=[O:16])[O:15][H:11])[F:18] | [
3.5902960300445557,
1.0578709840774536,
0.08802500367164612,
1.8107919692993164,
-0.35673999786376953,
0.5673940181732178,
0.7534890174865723,
-1.0519920587539673,
0.17068499326705933,
-2.0370900630950928,
-0.2207760065793991,
0.3858180046081543,
-1.5605839490890503,
1.2206230163574219,
... | [
-389506.0625
] | [
4.800414562225342,
3.988983392715454,
-0.025138219818472862,
-0.06631585210561752,
-2.808046817779541,
-6.738851547241211,
5.824542045593262,
-3.1505048274993896,
8.34466552734375,
-8.41661262512207,
5.262819766998291,
0.5530610084533691,
-0.3628944456577301,
-0.13263289630413055,
4.9933... |
[H:13][C:3](=[C:4]([H:14])[Cl:29])[N:24]([H:12])[C:2](=[O:26])[C:1]([H:9])([H:10])[H:11].[H:21][C:8]1([C@@:6]([N:25]1[H:23])([C:7]([H:18])([H:19])[O:27][H:20])[C:5]([H:16])([H:17])[S:28][H:15])[H:22] | [
5.015313148498535,
1.5183160305023193,
0.092678003013134,
4.413181781768799,
0.1892479956150055,
-0.30485600233078003,
2.4454450607299805,
-1.200937032699585,
-0.09191799908876419,
1.2063020467758179,
-1.4712209701538086,
0.3148980140686035,
-1.5551849603652954,
-0.3845680058002472,
0.26... | [
-898580.75
] | [
1.0500730276107788,
0.731569766998291,
-2.4730653762817383,
3.2369511127471924,
-2.319819211959839,
-1.188300609588623,
-2.409064292907715,
0.7395278215408325,
-2.4177918434143066,
18.834461212158203,
10.828136444091797,
9.506662368774414,
-137.90634155273438,
9.930655479431152,
-40.7000... |
[H:12][C:3]([H:13])([H:14])/[N:18]=[C:2](/[N:16]([H:9])[N:17]([H:10])[H:11])\[S:20][C:1]([H:6])([H:7])[H:8].[H:15][C:4]([C:5]#[N:19])([Cl:21])[Cl:22] | [
2.5295310020446777,
-1.6879329681396484,
-0.09904699772596359,
1.137470006942749,
0.7497599720954895,
0.1284399926662445,
0.37998199462890625,
2.144524097442627,
-1.608132004737854,
-1.2347389459609985,
-0.19958999752998352,
0.13932199776172638,
-2.533400058746338,
0.47710999846458435,
0... | [
-1088055.375
] | [
21.67525863647461,
10.577113151550293,
9.16201114654541,
52.825096130371094,
-0.08357784897089005,
-12.147583961486816,
-1.8396459817886353,
9.370559692382812,
-3.79390287399292,
-31.51874542236328,
-11.45455551147461,
4.245481014251709,
-19.204273223876953,
7.855532169342041,
-2.7230732... |
[H:5][C:2]([H:6])([H:7])[C:3]([H:8])([H:9])[O:13][C:4](=[S:16])[N:12]([H:10])[O:14][H:11].[C:1]([F:15])([Cl:17])([Cl:18])[Cl:19] | [
1.243904948234558,
0.42008501291275024,
0.14443500339984894,
-3.8031160831451416,
0.7595769762992859,
-0.479775995016098,
-2.3038361072540283,
0.9668099880218506,
-0.5338379740715027,
-0.7791060209274292,
-0.8584210276603699,
-0.013238999992609024,
-4.309086799621582,
1.7183040380477905,
... | [
-1405573.125
] | [
56.94847106933594,
59.30381774902344,
-20.449228286743164,
0.5727918744087219,
-1.6212284564971924,
3.8477864265441895,
-14.119726181030273,
2.6824636459350586,
0.30050602555274963,
-66.84957122802734,
-105.66059112548828,
56.56559371948242,
1.3640393018722534,
-0.2462736815214157,
-0.50... |
[H:12][C:3]1=[N:17][N:18]=[N:19][N:16]1[S:21][H:11].[H:4][C:1]([H:5])([H:6])[N:13]([H:7])[N:14]([H:8])[C:2](=[S:20])[N:15]([H:9])[H:10] | [
2.5384559631347656,
-1.105391025543213,
-1.617637038230896,
1.201166033744812,
0.5357170104980469,
0.7791619896888733,
-0.7096499800682068,
0.23272399604320526,
-0.48475098609924316,
3.3657150268554688,
-1.0615559816360474,
-2.3328959941864014,
1.6905380487442017,
-0.5315170288085938,
-2... | [
-815176.5625
] | [
-0.13629116117954254,
-0.06410904228687286,
-4.964642524719238,
-1.3714624643325806,
-22.77695083618164,
4.989740371704102,
-65.53313446044922,
-31.058279037475586,
-44.49827194213867,
-3.104832887649536,
-0.09347353130578995,
2.002551794052124,
3.035170555114746,
-2.098896026611328,
-2.... |
[H:13][C:4](=[S:23])[C:3]([H:11])([H:12])[N:17]([C:5](=[O:20])[H:14])[S:22][H:10].[H:8][C:2]1([O:19]/[C:1](=[N:15]/[S:21][H:6])/[N:16]([O:18]1)[H:7])[H:9] | [
2.0317940711975098,
-0.41286998987197876,
0.29376599192619324,
3.086405038833618,
-0.5679749846458435,
-1.6423979997634888,
-1.4577300548553467,
0.47081899642944336,
-1.0695830583572388,
-1.56381094455719,
1.601140022277832,
-0.0814640000462532,
-3.1291990280151367,
-1.233739972114563,
-... | [
-1117128.75
] | [
1.4517568349838257,
9.7741060256958,
-16.82613182067871,
2.115469217300415,
-0.04242630675435066,
-7.517343044281006,
-7.330037593841553,
0.5088204145431519,
-7.173327922821045,
-7.358742713928223,
2.9079484939575195,
-7.471100807189941,
5.0261311531066895,
5.5895562171936035,
-2.0612783... |
[H:11]/[C:2](=[C:3](/[H:12])\[Cl:26])/[C:1]([H:9])([H:10])[N:21]([H:7])[H:8].[H:13][C:4]([H:14])([H:15])[C:5]([H:16])([H:17])/[C:6](=[N:23]/[S:25][H:20])/[N:22]([H:18])[O:24][H:19] | [
-3.5585780143737793,
1.0152499675750732,
0.5354390144348145,
-2.95196795463562,
-0.36497199535369873,
0.5284640192985535,
-2.013641119003296,
-0.7342829704284668,
-0.3334819972515106,
4.341965198516846,
-1.2877789735794067,
0.024258000776171684,
3.4669899940490723,
-0.5179929733276367,
1... | [
-837579.0625
] | [
3.6324117183685303,
0.48939070105552673,
1.0441545248031616,
3.43205189704895,
-4.97769021987915,
-5.266048431396484,
-35.816322326660156,
-0.37712427973747253,
2.415260076522827,
0.2636933922767639,
-2.5306832790374756,
-1.6935433149337769,
0.5372196435928345,
1.052554965019226,
2.87904... |
[H:9][C@:2]([C:1]([H:7])([H:8])[N:14]([H:5])[H:6])([F:16])[Cl:19].[H:11][C:3]([H:12])([C:4](=[S:18])[O:15][H:13])[S:17][H:10] | [
2.112365961074829,
-0.9514359831809998,
-0.29600900411605835,
2.5489249229431152,
0.43063199520111084,
0.1640550047159195,
-2.849276065826416,
-0.24050399661064148,
0.7355639934539795,
-1.4442349672317505,
-0.46114200353622437,
0.1846340000629425,
3.4940710067749023,
-2.094438076019287,
... | [
-1031729.0625
] | [
15.145181655883789,
-15.646946907043457,
-11.269289016723633,
0.3213314116001129,
-10.20744514465332,
-1.0096969604492188,
3.4679882526397705,
1.1737279891967773,
2.149287700653076,
1.072951078414917,
-3.012737274169922,
22.743667602539062,
-0.9162803292274475,
-0.6747890710830688,
-2.42... |
[H:13][C:3]1=[C:2]([S:25][C:5]([C:4]1([H:14])[H:15])([H:16])[H:17])[C:1]([H:10])([H:11])[H:12].[H:23]/[C:8](=[C:9](\[H:24])/[Cl:27])/[C:7]([H:21])([H:22])[S:26][C:6]([H:18])([H:19])[H:20] | [
1.8429850339889526,
-1.9743690490722656,
-0.030998000875115395,
2.500190019607544,
-0.6467310190200806,
0.17766399681568146,
2.1087160110473633,
0.34561899304389954,
0.9774230122566223,
3.0383460521698,
1.5304880142211914,
1.0399810075759888,
3.9047229290008545,
1.464400053024292,
-0.227... | [
-1009310.5625
] | [
13.426411628723145,
-9.814318656921387,
5.4113545417785645,
3.8283140659332275,
3.3696539402008057,
5.36218786239624,
9.977762222290039,
-4.777343273162842,
1.179405689239502,
0.9680224657058716,
0.5869209170341492,
0.8693360686302185,
-0.07461897283792496,
1.5298597812652588,
0.15290214... |
[H:12][c:3]1[c:4]([c:5]([c:6]([c:1]([c:2]1[F:22])[O:21][H:11])[F:24])[H:13])[F:23].[H:18][C@:9]1([C@@:7]([C:8]1([H:16])[H:17])([H:15])[S:25][H:14])[C:10]([H:19])([H:20])[Cl:26] | [
2.612122058868408,
-1.224099040031433,
0.14495599269866943,
2.5579209327697754,
-0.7204059958457947,
-1.1628570556640625,
2.6244149208068848,
0.6632750034332275,
-1.3999979496002197,
2.7294020652770996,
1.4773590564727783,
-0.34708601236343384,
2.650247097015381,
0.9744709730148315,
0.95... | [
-1016644.5
] | [
-19.986539840698242,
-43.912513732910156,
-21.808147430419922,
18.107376098632812,
-4.701005935668945,
47.95955276489258,
8.467734336853027,
-66.06316375732422,
-99.14137268066406,
-3.5802972316741943,
26.107202529907227,
37.117122650146484,
-10.809085845947266,
4.780242443084717,
-5.609... |
[H+:12].[H:17][C:5]#[C:4][C@@:3]([H:15])([C:2]([H:13])([H:14])[C-:1]([H:10])[H:11])[S:25][H:16].[H:23]/[C:8](=[C:9](\[H:24])/[Cl:27])/[S:26][C:7]([H:21])([H:22])[C:6]([H:18])([H:19])[H:20] | [
2.5416769981384277,
-0.7717329859733582,
1.8165860176086426,
3.6140260696411133,
0.07782299816608429,
1.1430360078811646,
3.2080039978027344,
0.5694440007209778,
-0.28527700901031494,
2.168344020843506,
1.5915369987487793,
-0.07846699655056,
1.1727410554885864,
2.358078956604004,
-0.0869... | [
-1009201.1875
] | [
-58.81716537475586,
21.893152236938477,
3.8739991188049316,
24.713119506835938,
5.418701648712158,
-6.434983730316162,
13.637194633483887,
36.77914047241211,
32.04819869995117,
-112.56444549560547,
57.119911193847656,
-19.832923889160156,
92.75379180908203,
-59.51353454589844,
-3.2960073... |
[H:12][C:6](=[C:5]([C@:4]([H:11])([F:16])[Cl:19])[F:17])[H:13].[H:8][C@@:2]1([C:3]([S:18]1)([H:9])[H:10])[C:1]([H:7])([F:14])[F:15] | [
2.636924982070923,
0.48309600353240967,
-0.2099590003490448,
2.0673298835754395,
-0.6605960130691528,
0.578486979007721,
0.6917679905891418,
-0.5337460041046143,
1.1140379905700684,
-1.8345390558242798,
0.5295299887657166,
-0.7508329749107361,
-2.5223701000213623,
-0.5738750100135803,
-0... | [
-935363.5
] | [
-12.73299789428711,
-5.659267902374268,
0.39283761382102966,
5.128434181213379,
-1.5155255794525146,
5.2222371101379395,
8.728965759277344,
-0.7142674326896667,
10.53805160522461,
-10.057246208190918,
2.3529748916625977,
-3.275991916656494,
-8.50949478149414,
-0.6943954825401306,
-7.7511... |
[H:8][C:2](=[O:18])[N:15]([C:1](=[S:20])[H:7])[O:17][H:6].[H:9][C:3]([H:10])([H:11])[S:21][N:16]([H:12])[C:4](=[O:19])[C:5]([H:13])([H:14])[Cl:22] | [
3.411597967147827,
0.21912899613380432,
-0.8631110191345215,
2.342456102371216,
0.27685999870300293,
1.4116430282592773,
-4.6915059089660645,
-0.27173298597335815,
0.3785730004310608,
-1.0210039615631104,
-0.5473189949989319,
0.23685699701309204,
-0.9903079867362976,
0.6471080183982849,
... | [
-1121764.5
] | [
-0.6978129744529724,
-1.5649837255477905,
1.4350842237472534,
0.2728313207626343,
-13.568800926208496,
10.438661575317383,
-1.0829570293426514,
1.7353553771972656,
3.4517743587493896,
-3.559304714202881,
-5.3402276039123535,
3.1575496196746826,
-2.8739712238311768,
-1.7408801317214966,
-... |
[H:9][C@:2]([C:1]([H:7])([H:8])[O:17][H:6])([C:3]([H:11])([H:12])[Cl:22])[O:18][H:10].[H:13][S:20][C:4]1=[N:15][N:16]=[C:5]([O:19]1)[S:21][H:14] | [
-2.0576469898223877,
1.1612199544906616,
0.32246899604797363,
-3.1306378841400146,
0.09533300250768661,
0.5078309774398804,
-4.27577018737793,
0.2808699905872345,
-0.4741860032081604,
2.3392059803009033,
0.9546899795532227,
-0.35997501015663147,
3.2570340633392334,
-0.930620014667511,
-0... | [
-1121786.375
] | [
-5.666482448577881,
2.8146860599517822,
-4.746728897094727,
-2.9342358112335205,
4.327190399169922,
1.1975535154342651,
2.72721529006958,
3.4393718242645264,
-1.9487415552139282,
-6.636618137359619,
3.133664846420288,
-3.313983201980591,
-1.5872095823287964,
-3.7417337894439697,
-2.17752... |
[C:1]([F:4])([F:5])([F:6])[Cl:7].[F:2][F:3] | [
-1.1848779916763306,
-0.21857799589633942,
0.04248199984431267,
2.1964499950408936,
-0.6635159850120544,
-0.27771899104118347,
3.146347999572754,
0.14264699816703796,
0.2205210030078888,
-0.33063799142837524,
-1.250810980796814,
-0.10728500038385391,
-2.0818889141082764,
-0.421552985906600... | [
-625905.5625
] | [
100.9990234375,
4.444522380828857,
-29.507728576660156,
-28.71885108947754,
-26.527334213256836,
-16.0927791595459,
31.874773025512695,
26.734468460083008,
16.12705421447754,
15.894061088562012,
2.0837864875793457,
-6.730553150177002,
-56.271236419677734,
10.549903869628906,
-27.59449958... |
[H:14][C:3](=[S:25])[C@@:2]([H:13])([C:4]#[N:24])[C:1]([H:10])([H:11])[H:12].[H:15][C:5]([H:16])([H:17])[C:6](=[C:8]([C:9]([H:21])([H:22])[H:23])[Cl:26])[C:7]([H:18])([H:19])[H:20] | [
1.5584839582443237,
-0.27601999044418335,
0.8792939782142639,
2.6431050300598145,
0.6574249863624573,
0.6899909973144531,
3.937474012374878,
0.051548998802900314,
0.10238900035619736,
2.268083095550537,
1.8512049913406372,
-0.088687002658844,
-4.482564926147461,
0.5057939887046814,
0.761... | [
-793374
] | [
-78.2933120727539,
-48.99150848388672,
-18.626169204711914,
45.4360237121582,
26.542224884033203,
-4.90002965927124,
42.43844223022461,
18.107812881469727,
-17.786283493041992,
1.381498098373413,
50.825870513916016,
-35.4443244934082,
24.43592643737793,
90.94820404052734,
-27.87371826171... |
[H:10][C:3](=[S:23])[C@@:2]([H:9])([C:1]([H:7])([H:8])[S:22][H:6])[Cl:25].[H:13]/[C:4](=[N:19]/[O:21][H:14])/[N:18](/[C:5](=[N:20]\[S:24][H:16])/[H:15])[N:17]([H:11])[H:12] | [
3.2136590480804443,
-0.6202279925346375,
-0.62288498878479,
3.7085659503936768,
0.16540899872779846,
0.6159650087356567,
3.3971750736236572,
1.6287620067596436,
0.6311360001564026,
-4.4675188064575195,
1.0406370162963867,
0.8133630156517029,
-4.291797161102295,
-1.3011679649353027,
-0.12... | [
-1346598.25
] | [
-25.13604736328125,
13.940933227539062,
11.7941312789917,
1.4260730743408203,
-7.937915802001953,
-19.439834594726562,
-4.901738166809082,
16.12584686279297,
-14.857115745544434,
-12.590079307556152,
-64.91240692138672,
-24.258241653442383,
8.50110149383545,
-48.751434326171875,
-13.3026... |
[H:15]/[C:6](=[C:7](\[H:16])/[F:19])/[C:5](=[O:18])[S:22][H:14].[H:11][C@@:3]1([C:4]([O:17]1)([H:12])[H:13])[C:2](=[S:21])[S:20][C:1]([H:8])([H:9])[H:10] | [
-3.6559879779815674,
-1.899530053138733,
0.2660999894142151,
-2.4140050411224365,
0.5769879817962646,
-0.2622799873352051,
-1.2537529468536377,
-0.17825299501419067,
0.33338499069213867,
-0.4668259918689728,
0.3892880082130432,
1.4213149547576904,
2.783308982849121,
-0.7820420265197754,
... | [
-1077358.25
] | [
1.1585637331008911,
-3.2309651374816895,
2.648468494415283,
-1.7113021612167358,
1.836932897567749,
-2.3091208934783936,
-8.97555160522461,
8.920755386352539,
-0.3682745099067688,
-38.2968635559082,
15.208335876464844,
14.533472061157227,
7.982846260070801,
-5.5566887855529785,
2.4786624... |
[H:12][C:4]1=[N:19][N:18]([C:3]([C:2]1=[C:1]([H:8])[Cl:22])([H:9])[H:10])[H:11].[H:13][C:6]1([C:5]([C:7]([N:20]1[H:15])([H:16])[H:17])([F:21])[Cl:23])[H:14] | [
4.046586036682129,
-0.38355401158332825,
0.695032000541687,
3.1139729022979736,
0.41495001316070557,
0.18247699737548828,
2.6890299320220947,
1.7656749486923218,
0.7135000228881836,
2.269412040710449,
0.2282940000295639,
-1.0005559921264648,
-3.323227882385254,
-0.3987799882888794,
0.434... | [
-914383.75
] | [
-2.2828028202056885,
3.809988498687744,
-0.4001920819282532,
3.0135092735290527,
-1.7442348003387451,
2.0313174724578857,
2.190343141555786,
0.6610098481178284,
1.9213430881500244,
-1.8986109495162964,
0.722800612449646,
-1.296819806098938,
-0.4494534432888031,
3.3724405765533447,
-5.382... |
[H:23][C:8](=[C:7]([C:6]([H:21])([H:22])[O:25][C:5]([H:18])([H:19])[H:20])[Cl:27])[H:24].[H:9][C:1]([H:10])([H:11])[C:2]([H:12])([H:13])[C:3]([H:14])([H:15])[C:4]([H:16])([H:17])[F:26] | [
-1.7305840253829956,
-2.1811459064483643,
-0.6291970014572144,
-1.4951720237731934,
-0.717369019985199,
-0.2447430044412613,
-2.828794002532959,
-0.08803799748420715,
0.23751300573349,
-2.3839640617370605,
1.2723100185394287,
0.7673280239105225,
1.7458759546279907,
2.6780591011047363,
-0... | [
-595885
] | [
-31.16752052307129,
15.31343936920166,
6.094743251800537,
-57.93640899658203,
-26.12246322631836,
-27.76081085205078,
25.595169067382812,
51.71736526489258,
6.346221446990967,
-39.831485748291016,
48.20308303833008,
-9.38004207611084,
-6.853278160095215,
51.67962646484375,
-6.21563625335... |
[H:5][C-:1]([H:6])[C:2]([H:7])([H:8])[F:16].[H:9][C:3]([H:10])([H:11])[O:15][C:4](=[S:17])[N@+:14]([H:12])([S:18][H:13])[Cl:19] | [
-1.7265299558639526,
-0.7477160096168518,
-0.11180400103330612,
-3.1254661083221436,
-0.19385500252246857,
0.020919999107718468,
2.9662749767303467,
-0.9064480066299438,
0.8544899821281433,
1.3006409406661987,
0.5818520188331604,
-0.036240000277757645,
-1.6716890335083008,
-1.4267220497131... | [
-1031417.125
] | [
-63.91848373413086,
-20.16657829284668,
-11.248684883117676,
6.276324272155762,
9.667524337768555,
-6.620687961578369,
7.05378532409668,
-9.657735824584961,
-5.628129482269287,
51.60551834106445,
45.7854118347168,
57.00325393676758,
-31.397584915161133,
6.968321800231934,
6.9731101989746... |
[H:5][C:2]([H:6])([C:1](=[S:10])[S:9][H:4])[F:8].[H:7][C:3]([Cl:11])([Cl:12])[Cl:13] | [
-1.777871012687683,
-0.13544200360774994,
0.24100199341773987,
-1.4876470565795898,
1.3586499691009521,
0.5535809993743896,
2.2278339862823486,
-0.3319920003414154,
-0.18672099709510803,
-3.2227540016174316,
-1.5886139869689941,
-0.4423559904098511,
-1.2453969717025757,
1.57704496383667,
... | [
-1501902
] | [
32.76905059814453,
3.9748685359954834,
28.035003662109375,
28.933971405029297,
37.08952713012695,
-48.52313995361328,
3.413461685180664,
51.65782165527344,
39.93726348876953,
-3.83280611038208,
7.184717655181885,
-13.307652473449707,
-6.726736068725586,
-8.48309326171875,
-29.66764259338... |
[H:6][C:3](=[O:9])[C:2](=[S:11])[C:1](=[S:10])[H:5].[H:8][C:4](=[S:13])[S:12][H:7] | [
1.1283810138702393,
0.7639080286026001,
-0.35650700330734253,
1.7193529605865479,
-0.590969979763031,
-0.29873400926589966,
2.514801025390625,
-1.0144890546798706,
0.924763023853302,
-3.295285940170288,
0.003965000156313181,
-0.12027300149202347,
0.15042200684547424,
0.8131750226020813,
... | [
-1143765
] | [
5.0038981437683105,
1.5235333442687988,
-1.976854920387268,
-1.024856448173523,
-1.1298716068267822,
-2.156357526779175,
-1.0458881855010986,
4.843151569366455,
8.361410140991211,
1.824013352394104,
-3.7136666774749756,
2.39473819732666,
13.779367446899414,
-3.054762840270996,
-2.5221927... |
[H:6][C:2](=[S:8])[C:1]([H:4])([H:5])[Cl:9].[C:3]([F:7])([Cl:10])([Cl:11])[Cl:12] | [
-1.7857170104980469,
0.7775859832763672,
0.56489497423172,
-2.1769509315490723,
-0.3694159984588623,
-0.32029300928115845,
1.7591450214385986,
-0.37009701132774353,
0.24619099497795105,
-0.9898790121078491,
0.45819398760795593,
1.240828037261963,
-2.6327641010284424,
1.1308189630508423,
... | [
-1540434.125
] | [
-47.623348236083984,
-2.5464534759521484,
-3.0936968326568604,
-1.6252803802490234,
3.9003870487213135,
0.8778846859931946,
7.211085796356201,
4.151749134063721,
3.956725597381592,
-46.52507019042969,
-4.44888973236084,
-5.732414245605469,
-2.557163715362549,
0.7584606409072876,
-4.59684... |
[H:4][C:1]([H:5])([H:6])[C:2](=[S:10])[S:9][H:7].[C:3]([F:8])([Cl:11])([Cl:12])[Cl:13] | [
3.0422210693359375,
0.5566909909248352,
1.1412240266799927,
2.1157779693603516,
0.18520699441432953,
0.013276999816298485,
-1.6769020557403564,
0.09164900332689285,
0.1627350002527237,
4.081554889678955,
0.34199199080467224,
0.8655819892883301,
2.8056960105895996,
-0.029774999246001244,
... | [
-1501825.375
] | [
-10.258278846740723,
-4.297372817993164,
2.6483261585235596,
19.7695255279541,
30.228870391845703,
7.923029899597168,
-31.807321548461914,
-47.223716735839844,
-6.78322696685791,
-2.4120631217956543,
1.7989901304244995,
0.8152626156806946,
3.030783176422119,
2.792588472366333,
3.66438388... |
[H:4][C:1](=[O:9])[N:8]([H:5])[C:2](=[S:12])[H:6].[H:7][C:3]([F:10])([F:11])[Cl:13] | [
0.851589024066925,
1.7561149597167969,
-0.517799973487854,
1.533944010734558,
-0.24261699616909027,
0.8871600031852722,
-1.6454139947891235,
-0.12613700330257416,
0.3704659938812256,
0.8891209959983826,
1.1428580284118652,
-1.384106993675232,
0.94691401720047,
1.5892289876937866,
1.61018... | [
-818703.9375
] | [
-5.58237361907959,
11.900408744812012,
44.866310119628906,
30.112346649169922,
-5.812261581420898,
2.777784585952759,
-34.09025955200195,
-98.25814056396484,
63.346256256103516,
10.946717262268066,
-12.497802734375,
-23.508756637573242,
16.302183151245117,
-17.877424240112305,
-63.786113... |
[H:24][C:9]#[C:8][C:7]([H:22])([H:23])[C@:6]([H:20])([C:5]([H:17])([H:18])[H:19])[S:26][H:21].[H:13][C:3](=[C:2]([C:1]([H:11])([H:12])[S:25][H:10])[C:4]([H:15])([H:16])[Cl:27])[H:14] | [
-1.9381309747695923,
-0.5821170210838318,
-0.5088980197906494,
-3.132427930831909,
-0.5103579759597778,
0.41190001368522644,
-3.2103359699249268,
-1.0791219472885132,
1.6123130321502686,
-4.300589084625244,
0.26300299167633057,
-0.13284599781036377,
3.3628549575805664,
0.5602899789810181,
... | [
-1009271.5625
] | [
-3.116915225982666,
-2.0581798553466797,
0.7781464457511902,
-0.13700738549232483,
0.5313272476196289,
1.4178376197814941,
0.5749844908714294,
0.8904650211334229,
-1.9870933294296265,
-4.1092729568481445,
-4.5940070152282715,
1.880665898323059,
0.45668578147888184,
0.8511254191398621,
0.... |
[H:24]/[C:8](=[C:6](/[C:7]([H:21])([H:22])[H:23])\[C:5]([H:19])([H:20])[C:4]([H:16])([H:17])[H:18])/[F:26].[H:9][C:1]([H:10])([H:11])[O:25][C:2]([H:12])([H:13])[C:3]([H:14])([H:15])[Cl:27] | [
-0.80035400390625,
-0.05240999907255173,
1.8491740226745605,
-1.8905320167541504,
1.195248007774353,
0.17721199989318848,
-3.221086025238037,
0.4538390040397644,
0.18230099976062775,
1.4696040153503418,
2.199212074279785,
-0.5040410161018372,
2.6234350204467773,
1.37705397605896,
0.07774... | [
-595925.875
] | [
4.218136310577393,
-4.880207538604736,
9.161017417907715,
-7.246283054351807,
2.191162586212158,
-2.6078944206237793,
-0.12804020941257477,
3.152658224105835,
2.046367883682251,
-4.095158100128174,
4.733958721160889,
-0.8872976899147034,
-0.18121716380119324,
0.6436956524848938,
1.388730... |
[H:11][C:4]#[C:3][C:2](=[S:16])[C:1]([H:8])([H:9])[H:10].[H:14]/[C:7](=[C:6](\[C:5]([H:12])([H:13])[Cl:17])/[F:15])/[Cl:18] | [
2.3881359100341797,
2.4940450191497803,
-0.009163999930024147,
1.5577210187911987,
1.2538700103759766,
-0.19906899333000183,
0.1788029968738556,
1.4919730424880981,
-0.5058169960975647,
-0.9777259826660156,
1.7259190082550049,
-0.7632619738578796,
-1.9065200090408325,
0.3491849899291992,
... | [
-1059939.875
] | [
-0.7752577662467957,
6.223983287811279,
-0.9087539315223694,
24.074310302734375,
6.453133583068848,
0.22754719853401184,
2.1535303592681885,
21.466232299804688,
-20.789304733276367,
47.44415283203125,
41.31977462768555,
-35.044921875,
-15.952991485595703,
-19.812442779541016,
30.21023941... |
[H:9][C@:1]1([C:3](=[S:20])[N:17]([C:2]1([H:10])[H:11])[S:19][H:12])[S:18][H:8].[H:13][C:4]([H:14])([H:15])[C:5]#[C:6][C:7](=[S:22])[S:21][H:16] | [
-0.6139230132102966,
-0.8512300252914429,
0.37918800115585327,
-0.4801819920539856,
0.5485759973526001,
-0.2723740041255951,
-2.1278669834136963,
-0.7016519904136658,
0.17805199325084686,
4.6469621658325195,
-1.6535069942474365,
-0.9777039885520935,
3.6717469692230225,
-0.6923289895057678,... | [
-1454325.375
] | [
-32.18854904174805,
-18.65340805053711,
-17.814441680908203,
-31.44180679321289,
-1.1865289211273193,
-11.728729248046875,
-3.9792287349700928,
-2.6520140171051025,
-7.085296154022217,
0.19024957716464996,
-1.0024967193603516,
1.8927695751190186,
-6.702841758728027,
7.6903767585754395,
3... |
[H:11][C:3](=[C:2]([H:10])[F:17])[H:12].[H:7]/[N:15]=[C:1](/[N:14]([H:6])[N:13]([H:4])[H:5])\[N:16]([H:8])[S:18][H:9] | [
-0.7794240117073059,
0.37910500168800354,
0.3095510005950928,
3.6417291164398193,
-0.01167299970984459,
-0.3825559914112091,
3.703835964202881,
0.6402779817581177,
0.764726996421814,
-2.786724090576172,
1.9493340253829956,
0.5086820125579834,
-3.2539749145507812,
1.2121540307998657,
-0.8... | [
-525042.9375
] | [
-2.899920701980591,
-0.3234255611896515,
0.19050095975399017,
-7.104553699493408,
9.93928050994873,
5.327404022216797,
3.527625560760498,
-2.7080631256103516,
-2.4882285594940186,
0.8180255889892578,
0.4631330668926239,
-3.4237678050994873,
1.0480369329452515,
2.076455593109131,
0.693512... |
[H:14][C:6](=[C:5]([C:7](=[O:19])[S:25][H:15])[S:24][C:4]([H:11])([H:12])[H:13])[F:20].[H:10][N:18]1[C:1](=[N:16][C:2](=[S:22])[N:17]([C:3]1=[S:23])[H:9])[S:21][H:8] | [
-3.697110891342163,
-1.1051900386810303,
-0.4093169867992401,
-3.2338778972625732,
1.1247080564498901,
-0.5737810134887695,
-2.164473056793213,
-0.029544999822974205,
1.290734052658081,
2.9833920001983643,
2.927623987197876,
-0.8373619914054871,
3.2010490894317627,
0.20982199907302856,
0... | [
-1632617.125
] | [
72.19983673095703,
61.9597053527832,
4.523552894592285,
-34.852333068847656,
29.431236267089844,
-41.473575592041016,
-70.87321472167969,
-45.63761520385742,
-40.76420593261719,
-54.21528625488281,
7.730016231536865,
-21.00523567199707,
81.15093231201172,
-5.330965042114258,
-45.62520217... |
[H:7][c:2]1[n:14][n:15][c:3]([n:16][n:17]1)[H:8].[H:6][N:13]1[C:1](=[N:10][N:11]=[N:12]1)[N:9]([H:4])[H:5] | [
-1.6154930591583252,
0.694275975227356,
0.3969709873199463,
0.9209920167922974,
-0.15592600405216217,
-0.8906790018081665,
3.035815954208374,
-0.21039700508117676,
0.46885499358177185,
-1.0074650049209595,
1.88884699344635,
1.9134900569915771,
-1.1119240522384644,
2.605926990509033,
0.41... | [
-382789.65625
] | [
-7.702888488769531,
-0.6417236328125,
1.5935276746749878,
1.7104068994522095,
-0.5293529033660889,
-5.343473434448242,
9.239104270935059,
-1.3675528764724731,
5.885238170623779,
0.3673258423805237,
-0.7703615427017212,
0.8109604716300964,
1.567647099494934,
-0.027473101392388344,
-0.0269... |
[H:10][C:5]#[C:4][C:3]#[C:2][C:1](=[S:17])[H:9].[H:11][C@:6]1([C:7]([C:8]1([F:15])[F:16])([H:12])[H:13])[F:14] | [
0.7986469864845276,
0.608735978603363,
-0.9467269778251648,
2.103972911834717,
0.21400900185108185,
-0.5563880205154419,
3.2219979763031006,
-0.13201099634170532,
-0.23784300684928894,
4.489377975463867,
-0.5221440196037292,
0.127701997756958,
5.603639125823975,
-0.8630939722061157,
0.45... | [
-630859.125
] | [
3.872544050216675,
13.977214813232422,
-1.5360580682754517,
12.715486526489258,
-4.689331531524658,
6.9529523849487305,
-11.609116554260254,
2.8993051052093506,
-3.302938461303711,
15.41016674041748,
-4.2409987449646,
4.543876647949219,
-7.73558235168457,
1.9262299537658691,
-2.512910127... |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.