ATOM 17
1 C8x C 20.2580 -16.6354
2 C8x C 20.2580 -15.2338
3 C8x C 21.4747 -14.5331
4 C8y C 22.6843 -15.2338
5 C8y C 22.6843 -16.6354
6 C8x C 21.4747 -17.3362
7 C5a C 23.8986 -17.3351
8 N1b N 25.1069 -16.6354
9 C8y C 26.3173 -17.3362
10 O5a O 23.9002 -18.7367
11 C8x C 27.5294 -16.6383
12 C8x C 28.7398 -17.3390
13 C8y C 28.7381 -18.7377
14 C8x C 27.5260 -19.4356
15 C8x C 26.3156 -18.7348
16 O1a O 23.8986 -14.5339
17 O1a O 29.9511 -19.4398
BOND 18
1 2 3 1
2 8 9 1
3 3 4 2
4 7 10 2
5 4 5 1
6 5 6 2
7 6 1 1
8 5 7 1
9 9 11 2
10 11 12 1
11 12 13 2
12 13 14 1
13 14 15 2
14 15 9 1
15 1 2 2
16 4 16 1
17 7 8 1
18 13 17 1
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