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[H:33][c:21]1[c:22]([c:23]2[c:24]([c:25]([c:20]1[C:18](=[O:19])[N:17]([H:34])/[N:16]=[C:15]\3/[C:9](=[C:10]([C:11]([C:14]3([H:35])[H:36])([H:12])[H:13])[H:37])[C:8]([H:38])([H:39])[C:5]([H:6])([H:7])[C:4]([H:40])([H:41])[C:3]([H:42])([H:43])[C:1]([H:2])([H:44])[H:45])[H:26])[O:27][C:28]([O:29]2)([H:30])[H:31])[H:32] | [
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[H:28][c:23]1[c:24]([c:25]([c:20]([c:21]([c:22]1[H:29])[H:30])[C:15]2=[N:14][C:13](=[C:12]([C:17](=[O:18])[N:16]2[H:19])[C:11]([H:35])([H:36])[C:9](=[O:10])[O:8][C:5]([H:6])([H:7])[C:4]([H:37])([H:38])[C:3]([H:39])([H:40])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])[C:31]([H:32])([H:33])[H:34])[H:26])[H:27] | [
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-649091.0625
] | [
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[H:15][c:14]1[c:13]([c:12]2[c:11]([c:10]([c:9]1[C:7](=[O:8])[N:6]([C:5]([H:44])([H:45])[C:1]([H:2])([H:3])[H:4])[C:37]([H:42])([H:43])[C:38]([H:39])([H:40])[H:41])[H:36])[C@:31]3([C:29](=[C:28]([C:27]([C@:25]3([C@:19]([N:17]2[H:18])([H:24])[C:20](=[O:21])[O:22][H:23])[H:26])([H:34])[H:35])[H:33])[H:30])[H:32])[H:16] | [
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[H:36][c:23]1[c:22]([c:21]([c:26]([c:25]([c:24]1[C:32]([H:33])([H:34])[H:35])[C:28]([H:29])([H:30])[H:31])[H:27])[N:20]([H:38])[C:18](=[O:19])[C:10]2=[C:11]([N:12]([C:8](=[C:9]2[C:39]([H:40])([H:41])[H:42])[C:6](=[O:7])[O:5][C:2]([H:3])([H:4])[C:1]([H:43])([H:44])[H:45])[H:13])[C:14]([H:15])([H:16])[H:17])[H:37] | [
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0.... | [
-649097
] | [
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[H+:42].[H:12][c:11]1[c:10]([c:9]2[c:4]([n:3][c:2]1[C:1]([H:43])([H:44])[H:45])[C-:5]=[C:6]([C:7](=[C:8]2[H:39])[H:40])[H:41])[C:13](=[O:14])[O:15][C:16]([H:17])([H:18])[C:19](=[O:20])[N:21]([H:22])[C:23]([H:24])([H:25])[C:26]([H:27])([H:28])[C:29]([H:38])([C:30]([H:31])([H:32])[H:33])[C:34]([H:35])([H:36])[H:37] | [
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[H:32][c:26]1[c:27]([c:28]([c:29]2[c:24]([c:25]1[H:33])[c:23]([c:22]([c:21]([c:20]2[C:19]([H:38])([H:39])[N:12]3[C:13]([C:14]([N:8]([C:9]([C:11]3([H:40])[H:41])([H:10])[H:42])[C:6](=[O:7])[O:5][C:2]([H:3])([H:4])[C:1]([H:43])([H:44])[H:45])([H:15])[H:16])([H:17])[H:18])[O:36][H:37])[H:35])[H:34])[H:30])[H:31] | [
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] | [
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3.441352... |
[H:18][c:14]1[c:13]([c:12]([c:11]2[c:16]([c:15]1[H:17])[C:8](=[C:9]([N:10]2[C:21]([H:22])([H:23])[C:24](=[O:25])[N:26]3[C:27]([C:29]([C:31]([C:34]([C:37]([C:40]3([H:41])[H:42])([H:38])[H:39])([H:35])[H:36])([H:32])[H:33])([H:30])[H:43])([H:28])[H:44])[H:45])[C:6](=[O:7])[O:5][C:1]([H:2])([H:3])[H:4])[H:20])[H:19] | [
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-0... | [
-649086.9375
] | [
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[H+:42].[H:15][c:14]1[c:13]([c:12]2[c:11]([c:10]([c:9]1[C:7](=[O:8])/[N+:6](=[C:37](\[H:43])/[C:38]([H:39])([H:40])[H:41])/[C:5]([H:44])([H:45])[C:1]([H:2])([H:3])[H:4])[H:36])[C@@:31]([C-:25]([C@:19]([N:17]2[H:18])([H:24])[C:20](=[O:21])[O:22][H:23])[H:26])([H:32])[C-:29]([H:30])[C:28](=[C:27]([H:34])[H:35])[H:33])[H:... | [
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1.2... | [
-648612.5
] | [
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231.78643798828125,
284.799682... |
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