ATOM 15
1 C8x C 12.8100 -19.0400
2 C8x C 12.8100 -20.4400
3 C8y C 14.0224 -21.1400
4 C8y C 15.2349 -20.4400
5 C8y C 15.2349 -19.0400
6 C8x C 14.0224 -18.3400
7 N4y N 16.5664 -20.8726
8 C8y C 17.3893 -19.7400
9 S2x S 16.5664 -18.6074
10 X Cl 14.0224 -22.5398
11 O5x O 18.7600 -19.7400
12 C1b C 16.9975 -22.1994
13 C6a C 18.3769 -22.4926
14 O6a O 19.3395 -21.4231
15 O6a O 18.8063 -23.8127
BOND 16
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 5 9 1
11 3 10 1
12 8 11 2
13 7 12 1
14 12 13 1
15 13 14 2
16 13 15 1
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