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[H:38][c:8]1[c:7]([c:6]([c:11]([c:10]([c:9]1[H:37])[O:13][C:14]([H:35])([H:36])[C:15]([H:16])([H:17])[O:18][C:19]([H:20])([H:21])[C:22]([H:33])([H:34])[N+:23]([H:32])([C:24]([H:25])([H:26])[H:27])[C:28]([H:29])([H:30])[H:31])[H:12])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:39] | [
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[H+:27].[H:30][c:13]1[c:14]([c:15]([c:16]([c:17]([c:12]1[C:11]([H:31])([H:32])[N+:9]([H:10])([H:33])[C:8]([H:34])([H:35])[C:7]([H:36])([H:37])[C:6]([H:38])([H:39])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:18])[O:19][C:20]([H:21])([H:22])[H:23])[O:24][C-:25]([H:26])[H:28])[H:29] | [
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[H:38][c:8]1[c:7]([c:6]([c:11]([c:10]([c:9]1[H:37])[O:13][C:14]([H:35])([H:36])[C:15]([H:16])([H:17])[O:18][C:19]([H:20])([H:21])[C:22]([H:33])([H:34])[N+:23]([H:32])([C:24]([H:25])([H:26])[H:27])[C:28]([H:29])([H:30])[H:31])[H:12])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:39] | [
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0.1835249960422516,
... | [
-519623.15625
] | [
9.461668014526367,
2.0309271812438965,
3.2775204181671143,
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2.965301990509033,
-2.0941812992095947,
3.7244386672973633,
4.1072368... |
[H:30][c:13]1[c:14]([c:15]([c:16]([c:17]([c:12]1[C:11]([H:31])([H:32])[N+:9]([H:10])([H:33])[C:8]([H:34])([H:35])[C:7]([H:36])([H:37])[C:6]([H:38])([H:39])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:18])[O:19][C:20]([H:21])([H:22])[H:23])[O:24][C:25]([H:26])([H:27])[H:28])[H:29] | [
-1.9147590398788452,
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0.9581249952316284,
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... | [
-519626
] | [
-1.0228667259216309,
6.541059970855713,
7.86236572265625,
4.594905853271484,
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0.3615236282348633,
-3.2142913341522217,
1.372240424156189,
-3.2512... |
[H:30][c:13]1[c:14]([c:15]([c:16]([c:17]([c:12]1[C:11]([H:31])([H:32])[N+:9]([H:10])([H:33])[C:8]([H:34])([H:35])[C:7]([H:36])([H:37])[C:6]([H:38])([H:39])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:18])[O:19][C:20]([H:21])([H:22])[H:23])[O:24][C:25]([H:26])([H:27])[H:28])[H:29] | [
-1.4934029579162598,
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... | [
-519626.8125
] | [
-8.780278205871582,
4.214057922363281,
0.7145828604698181,
4.776182174682617,
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2.8927879333496094,
0.29969727993011475,
3.748887777328491,
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4.7902... |
[H:38][c:8]1[c:7]([c:6]([c:11]([c:10]([c:9]1[H:37])[O:13][C:14]([H:35])([H:36])[C:15]([H:16])([H:17])[O:18][C:19]([H:20])([H:21])[C:22]([H:33])([H:34])[N+:23]([H:32])([C:24]([H:25])([H:26])[H:27])[C:28]([H:29])([H:30])[H:31])[H:12])[O:5][C:2]([H:3])([H:4])[C:1]([H:40])([H:41])[H:42])[H:39] | [
4.0623459815979,
1.0401819944381714,
1.987347960472107,
2.793816089630127,
0.43018200993537903,
1.6378519535064697,
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1.166314959526062,
1.766605019569397,
2.6452810764312744,
-0.19892199337482452,
0.1456000059... | [
-519263.5
] | [
-210.43460083007812,
171.57135009765625,
134.0916748046875,
-87.53577423095703,
49.02594757080078,
-79.22330474853516,
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-72.07720947265625,
42.11125183105469,
27.887083053588867,
-22.484031677246094,
-12.689356803894043,
56.7391357421875,
71.39586639404297,
103.580055... |
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