ATOM 15
1 N1y N 17.0089 -16.5030
2 C1y C 17.0089 -15.1073
3 C1y C 18.3404 -16.9293
4 C5x C 15.6016 -16.5147
5 C1x C 15.6016 -15.1073
6 C1x C 18.3345 -14.6809
7 C1y C 19.1580 -15.8022
8 C6a C 18.7783 -18.2608
9 O5x O 14.5969 -17.5017
10 S2a S 20.5594 -15.8022
11 O6a O 20.1448 -18.5470
12 O6a O 17.8440 -19.3003
13 C1b C 21.7625 -15.1014
14 C1b C 22.9714 -15.7905
15 N1a N 24.1802 -15.0957
BOND 16
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 7 10 1
10 8 11 1
11 8 12 2
12 10 13 1
13 13 14 1
14 14 15 1
15 4 5 1
16 6 7 1
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