ATOM 13
1 C8y C 22.8273 -18.5270
2 C1b C 24.0336 -17.8220
3 C8x C 22.8273 -19.9314
4 C8x C 21.6210 -17.8220
5 C5a C 25.2397 -18.5213
6 C8x C 21.6210 -20.6250
7 C8x C 20.4030 -18.5270
8 N1b N 26.4520 -17.8160
9 O5a O 25.2397 -19.9257
10 C8x C 20.4030 -19.9314
11 C5a C 27.6583 -18.5154
12 N1a N 28.8704 -17.8103
13 O5a O 27.6640 -19.9140
BOND 13
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 3 6 2
6 4 7 1
7 5 8 1
8 5 9 2
9 6 10 1
10 8 11 1
11 11 12 1
12 11 13 2
13 7 10 2
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