ATOM 16
1 C8y C 26.5719 -18.3541
2 C8x C 26.5790 -19.7552
3 C8x C 25.3680 -20.4654
4 C8x C 24.1502 -19.7673
5 C8x C 24.1431 -18.3663
6 C8x C 25.3540 -17.6632
7 C1x C 32.6271 -16.2910
8 C1x C 32.6271 -17.6922
9 S2x S 31.4099 -18.3893
10 C2y C 30.1996 -17.6922
11 C2y C 30.1996 -16.2910
12 O2x O 31.4099 -15.5870
13 C1a C 28.9848 -15.5879
14 C5a C 28.9870 -18.3752
15 N1b N 27.7899 -17.6711
16 O5a O 28.9755 -19.7763
BOND 17
1 5 6 2
2 7 8 1
3 8 9 1
4 9 10 1
5 10 11 2
6 11 12 1
7 12 7 1
8 6 1 1
9 11 13 1
10 10 14 1
11 1 2 2
12 14 15 1
13 15 1 1
14 2 3 1
15 14 16 2
16 3 4 2
17 4 5 1
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