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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N+:9](=[C:8]([H:71])[H:72])[C:65]([H:66])([H:70])[C:67]([H:68])([H:69])[N+:6](=[C:7]([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[N:16]([H:42])[C:17](=[C:19]([H:41])[C:20](=[C:21]2[C:22](=[C:23]([C:24](=[C:25]([C:26]2=[O:27])[H:32])[H:33])[O:34][C:35]([H:...
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[ -1306409.625 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[ -1307181.25 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
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[ -1307188.25 ]
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
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[ -1307238.875 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])[C:19](=[C:20]([H:40])[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:31])...
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[ -1306609.5 ]
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ -5.542235851287842, -2.1051809787750244, -0.008101999759674072, -5.4403510093688965, -1.0655070543289185, -0.37986400723457336, -6.317574977874756, -2.2114880084991455, 0.4820779860019684, -5.6012420654296875, -2.7379350662231445, -1.0233999490737915, -4.314341068267822, -2.608957052230835...
[ -1306510 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[ -1307181.625 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[ -1307180.875 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ 4.57920503616333, 5.219147205352783, -1.0956560373306274, 5.034152984619141, 5.962102890014648, -1.7456560134887695, 5.3512468338012695, 4.544940948486328, -0.7356770038604736, 4.143054962158203, 5.7358198165893555, -0.24526800215244293, 3.53256893157959, 4.429594039916992, -1.8734920024...
[ -1307185 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
[ -6.498361110687256, -1.4415299892425537, 2.4274559020996094, -6.162407875061035, -0.6625819802284241, 3.1077470779418945, -7.310842037200928, -1.983428955078125, 2.903860092163086, -5.67841911315918, -2.1348071098327637, 2.2560839653015137, -6.99127197265625, -0.8410850167274475, 1.10614...
[ -1307180.25 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ 1.4415169954299927, 6.487372875213623, 2.6606459617614746, 1.0283290147781372, 5.758604049682617, 3.3526298999786377, 0.6266949772834778, 6.937673091888428, 2.100517988204956, 1.939666986465454, 7.259961128234863, 3.2404839992523193, 2.435425043106079, 5.849667072296143, 1.69674205780029...
[ -1307190.5 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N+:9](=[C:8]([H:71])[H:72])[C:65]([H:66])([H:70])[C:67]([H:68])([H:69])[N+:6](=[C:5]([H:75])[H:76])[C-:7]([H:73])[H:74])[N:16]([H:42])[C:17](=[O:18])[C:19](=[C:20]([H:40])[c:21]2[c:22]([c:23]([c:24]([c:25]([c:26]2[O:27][C:28]([H:29])([H:30])[H:31])[H:32])[H:33])[O:34][C:...
[ -7.2077789306640625, -1.0117290019989014, 2.5276479721069336, -7.943253040313721, -1.352288007736206, 3.0467400550842285, -7.028634071350098, 0.16119599342346191, 2.4926469326019287, -6.293900966644287, -1.4846440553665161, 2.818247079849243, -7.4535908699035645, -1.6228339672088623, 0.8...
[ -1306398.5 ]
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ 1.560549020767212, 3.614622116088867, 2.2187860012054443, 0.9001659750938416, 4.4277729988098145, 1.9312160015106201, 2.5885140895843506, 3.9236900806427, 2.0411930084228516, 1.4290720224380493, 3.435213088989258, 3.2827539443969727, 1.202636957168579, 2.3704400062561035, 1.3986610174179...
[ -1307238 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ 7.26235818862915, -0.6141110062599182, 2.7093770503997803, 7.25113582611084, 0.45553499460220337, 2.5144460201263428, 8.08456802368164, -0.828836977481842, 3.386521100997925, 6.332767963409424, -0.8905829787254333, 3.2009201049804688, 7.450257778167725, -1.406527042388916, 1.410871982574...
[ -1307189.75 ]
[ -0.30800753831863403, -3.4521408081054688, -7.299309730529785, -0.3020985722541809, 2.933467388153076, 1.2396596670150757, 1.6092931032180786, 0.26982173323631287, 2.6800267696380615, -1.9485186338424683, 0.4573083221912384, 2.5137436389923096, 1.7364842891693115, 1.5195454359054565, 5.0...
[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ -0.23902000486850739, -6.158690929412842, -0.5613629817962646, -0.6683189868927002, -5.877354145050049, -1.5526080131530762, -0.8598819971084595, -6.333756923675537, 0.08779200166463852, 0.3600800037384033, -7.072659969329834, -0.8986960053443909, 0.6637669801712036, -5.213457107543945, ...
[ -1306359.25 ]
[ 75.6136245727539, -98.7195053100586, -255.52267456054688, -16.59244728088379, -9.053610801696777, 14.92146110534668, -152.8219451904297, -47.28227233886719, 155.321533203125, -24.887760162353516, 10.425333023071289, 18.954116821289062, 87.85453033447266, 170.94398498535156, 172.445114135...
[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ -0.396016001701355, -4.865272045135498, -1.3822510242462158, 0.646826982498169, -4.778670787811279, -1.0856629610061646, -0.5569559931755066, -4.252170085906982, -2.2652618885040283, -0.5966320037841797, -5.899868965148926, -1.648429036140442, -1.3091579675674438, -4.443962097167969, -0....
[ -1307233.75 ]
[ -5.732075214385986, 0.7496132254600525, 4.83761739730835, 2.718308448791504, -0.21831676363945007, 0.23778438568115234, 0.31602248549461365, 1.1262003183364868, -3.1918163299560547, 0.3868361711502075, -2.4565954208374023, -2.324213981628418, 3.9538700580596924, -3.413891077041626, -3.64...
[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
[ -7.8512959480285645, -1.6905570030212402, 1.9370180368423462, -8.349623680114746, -2.3720591068267822, 2.6214559078216553, -7.94974422454834, -0.6831300258636475, 2.3323090076446533, -8.346549987792969, -1.7373509407043457, 0.9711549878120422, -6.3901238441467285, -2.0972139835357666, 1....
[ -1307182.25 ]
[ 6.215061187744141, -1.6762932538986206, 1.1001763343811035, -2.278287172317505, -0.2773599922657013, 2.2028346061706543, -1.744645118713379, 2.1390597820281982, 1.0594054460525513, -1.9210134744644165, -0.21326042711734772, -2.064689874649048, -4.588341236114502, 0.22073347866535187, -0....
[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -8.41977310180664, -0.911728024482727, 0.7756770253181458, -8.278799057006836, -0.34984201192855835, 1.6947530508041382, -8.313732147216797, -1.9709579944610596, 0.9937620162963867, -9.42922592163086, -0.7416250109672546, 0.41054999828338623, -7.412325859069824, -0.44646400213241577, -0....
[ -1307190.25 ]
[ 3.4412643909454346, 1.0165486335754395, -5.459395408630371, -0.372938334941864, 1.2831686735153198, 2.515657663345337, -1.0163791179656982, -2.4211952686309814, 1.3526115417480469, -2.9836370944976807, -1.0507928133010864, -0.00668921647593379, -3.3805718421936035, 0.00746355764567852, 3...
[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ 3.8171560764312744, 5.311795234680176, -1.5696580410003662, 3.426529884338379, 5.763344764709473, -0.6619319915771484, 3.8202219009399414, 6.06525182723999, -2.3533809185028076, 4.837562084197998, 4.9908671379089355, -1.381762981414795, 2.973814010620117, 4.114624977111816, -2.0003600120...
[ -1307184.75 ]
[ -4.360228538513184, -4.082884788513184, -3.4800846576690674, -0.30174046754837036, 2.2505152225494385, 2.41593599319458, -0.04344967007637024, 3.619391441345215, -0.8264449238777161, 2.612574815750122, -0.3689267039299011, 0.34398651123046875, 3.6994640827178955, 4.515491485595703, 2.253...
[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
[ -8.42734146118164, -0.051061999052762985, -0.6224949955940247, -8.83596420288086, -1.05731999874115, -0.6257500052452087, -8.372406959533691, 0.29364699125289917, 0.40656399726867676, -9.098607063293457, 0.6065099835395813, -1.1690599918365479, -7.049868106842041, -0.05390800163149834, -...
[ -1307177 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -7.651909828186035, -3.096532106399536, 0.2107830047607422, -7.683913230895996, -2.8587300777435303, -0.8496779799461365, -8.556734085083008, -3.641319990158081, 0.4663800001144409, -6.798572063446045, -3.742901086807251, 0.39999398589134216, -7.56960391998291, -1.82041597366333, 1.05527...
[ -1307191.125 ]
[ 1.7104780673980713, 6.962057113647461, 3.7136049270629883, -0.10238734632730484, -1.2069309949874878, -2.98014497756958, -2.0178382396698, -2.3204596042633057, -0.24365301430225372, 1.4896188974380493, -2.802340507507324, -0.7953823208808899, -2.878269910812378, -4.4349870681762695, -1.1...
[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -5.472815036773682, -3.575040102005005, -3.1213669776916504, -4.415370941162109, -3.6563448905944824, -3.36102294921875, -5.8010759353637695, -2.558145046234131, -3.322917938232422, -6.024052143096924, -4.246860980987549, -3.7736101150512695, -5.732587814331055, -3.956070899963379, -1.65...
[ -1307182.5 ]
[ -0.44778379797935486, -0.812644362449646, 8.00906753540039, 2.2374379634857178, 0.32691189646720886, -2.26078200340271, -0.2186393141746521, 2.2995927333831787, -2.153881549835205, -0.9269397258758545, -1.0785990953445435, -2.7850489616394043, -0.9219462275505066, -0.7115317583084106, -5...
[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
[ -8.486783981323242, -2.041780948638916, 0.9436699748039246, -9.324212074279785, -2.682760000228882, 0.6807569861412048, -8.253661155700684, -2.181283950805664, 1.995581030845642, -8.788884162902832, -1.0098459720611572, 0.7866960167884827, -7.27396821975708, -2.4103879928588867, 0.096651...
[ -1307186.625 ]
[ 4.130352020263672, -1.4235165119171143, -4.866950035095215, -3.173168182373047, -0.18741783499717712, -0.31570112705230713, -0.15870554745197296, -0.4437887668609619, 2.7681570053100586, -1.964473843574524, 2.182589054107666, 0.45153337717056274, -3.5818850994110107, -0.03710315376520157, ...
[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ 2.4727699756622314, 5.3826518058776855, 0.30379900336265564, 2.7608699798583984, 5.545464038848877, 1.3396689891815186, 2.2848920822143555, 6.348899841308594, -0.15690499544143677, 3.304887056350708, 4.914341926574707, -0.21557800471782684, 1.2079609632492065, 4.522368907928467, 0.213827...
[ -1307237.25 ]
[ -5.755390644073486, -5.966490745544434, 0.11209210753440857, 1.814467430114746, 1.2388675212860107, 1.986289381980896, 0.6498394012451172, 2.6742255687713623, -0.8166725635528564, 3.267488479614258, 0.055317364633083344, -1.0878342390060425, 1.6865564584732056, 5.938029766082764, -2.0562...
[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -6.377471923828125, -0.5707640051841736, -3.1471970081329346, -6.949163913726807, -0.7264789938926697, -4.074800968170166, -5.248332977294922, -0.5953180193901062, -3.6154580116271973, -6.503256797790527, 0.41086798906326294, -2.8884620666503906, -6.718687057495117, -1.7753649950027466, ...
[ -1306594.25 ]
[ 66.94570922851562, -75.00389099121094, -97.52063751220703, -1.868297815322876, 7.345076084136963, 0.7947799563407898, -56.944183349609375, -4.57273006439209, 33.523956298828125, -16.30352210998535, 49.436927795410156, 35.542320251464844, -35.361915588378906, 303.4687194824219, 200.529342...
[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ -5.059357166290283, -2.9111549854278564, -0.9298589825630188, -4.673503875732422, -3.3486549854278564, -1.9760700464248657, -4.974254131317139, -1.7385139465332031, -1.1490130424499512, -6.055884838104248, -3.2892749309539795, -0.7959139943122864, -4.1131591796875, -3.49926495552063, -0....
[ -1306523.375 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
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[ -1307192.375 ]
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
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[ -1307241.125 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
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[ -1307184.875 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[ -1307180.875 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
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[ -1307193.125 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -7.299911975860596, -4.11187219619751, -0.9607369899749756, -6.484510898590088, -4.82266902923584, -0.8596649765968323, -7.36381196975708, -3.79771089553833, -1.998824954032898, -8.22336483001709, -4.616116046905518, -0.6881380081176758, -7.099487781524658, -2.893441915512085, -0.0669260...
[ -1307192.125 ]
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[H+:60].[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:...
[ -3.689192056655884, -3.994457960128784, -0.6445620059967041, -3.0511770248413086, -3.9494259357452393, -1.6772680282592773, -3.8147480487823486, -2.893660068511963, -0.43035998940467834, -4.616736888885498, -4.563292980194092, -0.9176350235939026, -2.8810770511627197, -4.911261081695557, ...
[ -1306514.625 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -5.294555187225342, -2.2923920154571533, -1.1042100191116333, -4.958388805389404, -2.5545248985290527, -0.10451000183820724, -6.279624938964844, -2.724838972091675, -1.2618060111999512, -5.377754211425781, -1.2097289562225342, -1.1700730323791504, -4.328417778015137, -2.830436944961548, ...
[ -1307189 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
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[ -1307183.375 ]
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[H:70][c:65]1[c:66]([c:67]([c:62]([c:63]([c:64]1[H:71])[H:72])[C:61]([H:73])([H:74])[N:6]([C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])[C:7]([H:8])([H:60])[C:9]([H:58])([H:59])[C:10]([H:56])([H:57])[N:11]([H:55])[C:12](=[O:13])[C:14]([H:53])([H:54])[N:15]2[c:26]3[c:25]([c:24]([c:23]([c:22]([c:21]3[O:20][C:18]([C:16]2=...
[ -1.412155032157898, -5.1907148361206055, 0.7233880162239075, -2.089128017425537, -5.367531776428223, -0.1082720011472702, -1.8200370073318481, -4.386952877044678, 1.331413984298706, -1.3705869913101196, -6.093072891235352, 1.3280390501022339, -0.011195999570190907, -4.83200216293335, 0.2...
[ -1307238.375 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -2.620129108428955, -5.841989040374756, -2.7360880374908447, -1.5716530084609985, -5.360703945159912, -3.0403590202331543, -3.324738025665283, -5.093914031982422, -3.1468210220336914, -2.674139976501465, -6.781840801239014, -3.4424490928649902, -2.747718095779419, -6.376855850219727, -1....
[ -1306649 ]
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[H:64][c:11]1[c:12]([c:13]([c:14]([c:15]([c:10]1[N:9]2[C:65]([C:67]([N:6]([C:7]([C:8]2([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2])([H:3])[H:4])([H:68])[H:69])([H:66])[H:70])[N:16]([H:42])[C:17](=[O:18])/[C:19](=[C:20](\[H:40])/[c:21]3[c:22]([c:23]([c:24]([c:25]([c:26]3[O:27][C:28]([H:29])([H:30])[H:3...
[ -7.82588005065918, -1.4346059560775757, 1.272202968597412, -7.071077823638916, -1.5217759609222412, 2.0501410961151123, -7.596945762634277, -2.143620014190674, 0.4801729917526245, -8.78959846496582, -1.6993680000305176, 1.6986910104751587, -7.884923934936523, -0.0031330001074820757, 0.72...
[ -1307182.25 ]
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[H:38][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[H:37])[O:32][C:33]([H:34])([H:35])[H:36])[O:27][C:28]([H:29])([H:30])[H:31])/[C:20](=[C:19](\[H:41])/[C:17](=[O:18])[N:16]([H:42])[c:15]2[c:14]([c:13]([c:12]([c:11]([c:10]2[N:9]3[C:65]([C:67]([N:6]([C:7]([C:8]3([H:71])[H:72])([H:73])[H:74])[C:5]([H:75])([H:76])[C:1]([H:2...
[ -7.891110897064209, -3.053096055984497, 1.6769570112228394, -8.790976524353027, -3.6578280925750732, 1.600566029548645, -7.111135959625244, -3.6636030673980713, 2.1234400272369385, -8.090134620666504, -2.2071099281311035, 2.32903790473938, -7.492499828338623, -2.5527169704437256, 0.29328...
[ -1307185.625 ]
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