ATOM 15
1 C5x C 20.9955 -19.9317
2 C1x C 21.4388 -21.2611
3 S2x S 22.8401 -21.2502
4 C2y C 23.2628 -19.9141
5 N1y N 22.1227 -19.0994
6 C1b C 22.1119 -17.6839
7 C2b C 20.9056 -16.9996
8 O5x O 19.6755 -19.5146
9 N1b N 25.5295 -19.9662
10 N2b N 24.4151 -19.1168
11 N1b N 27.7963 -20.0182
12 C2c C 26.6819 -19.1687
13 C1a C 28.9887 -19.2822
14 S0 S 26.6819 -17.7675
15 C2a C 20.8951 -15.6104
BOND 15
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 5 6 1
7 6 7 1
8 1 8 2
9 9 10 1
10 4 10 2
11 11 12 1
12 9 12 1
13 11 13 1
14 12 14 2
15 7 15 2
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