ATOM 16
1 C8y C 28.2396 -19.8154
2 C8y C 29.0691 -20.9546
3 C8y C 26.9076 -20.2535
4 C8x C 29.0574 -18.6760
5 N4x N 28.2396 -22.0821
6 S2x S 30.4011 -20.5105
7 C8y C 26.9076 -21.6497
8 C8x C 25.7040 -19.5524
9 C8y C 30.3953 -19.1084
10 C8x C 25.7040 -22.3508
11 C8x C 24.4889 -20.2535
12 C5a C 31.3768 -18.1212
13 C8y C 24.4889 -21.6497
14 N1a N 32.7264 -18.4775
15 O5a O 31.0088 -16.7656
16 X Cl 23.2736 -22.3391
BOND 18
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 7 10 1
10 8 11 2
11 9 12 1
12 10 13 2
13 12 14 1
14 12 15 2
15 13 16 1
16 5 7 1
17 6 9 1
18 11 13 1
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