ATOM 14
1 C8x C 10.8500 -22.6800
2 C8x C 10.8500 -21.2800
3 C8x C 12.0400 -20.5800
4 C8y C 13.3000 -21.2800
5 C8x C 13.3000 -22.6800
6 C8x C 12.0400 -23.3800
7 N1c N 14.4900 -20.5800
8 C5a C 15.7500 -21.2800
9 C1b C 16.9400 -20.5800
10 X Cl 18.1300 -21.2800
11 C1c C 14.4900 -19.1800
12 C1a C 15.6800 -18.4800
13 C1a C 13.3000 -18.4800
14 O5a O 15.7500 -22.6800
BOND 14
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 9 10 1
11 7 11 1
12 11 12 1
13 11 13 1
14 8 14 2
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