ATOM 16
1 C8x C 15.5400 -20.4400
2 C8x C 15.5400 -21.8400
3 C8y C 16.7524 -22.5400
4 C8x C 17.9649 -21.8400
5 C8y C 17.9649 -20.4400
6 C8x C 16.7524 -19.7400
7 X Cl 16.7524 -23.9398
8 N1b N 19.2024 -19.7400
9 C7a C 20.4149 -20.4400
10 O7a O 21.6273 -19.7400
11 C1b C 22.8397 -20.4400
12 C3b C 24.0522 -19.7400
13 C3b C 25.2646 -19.0400
14 C1b C 26.4770 -18.3400
15 X Cl 27.6766 -19.0327
16 O6a O 20.4149 -21.8398
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 3 7 1
8 5 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 3
14 13 14 1
15 14 15 1
16 9 16 2
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