ATOM 12
1 C8y C 18.4800 -14.4200
2 C8y C 18.4800 -15.8200
3 C8x C 19.6924 -16.5200
4 C8y C 20.9049 -15.8200
5 C8y C 20.9049 -14.4200
6 C8x C 19.6924 -13.7200
7 N4x N 22.2364 -16.2526
8 C8y C 23.0593 -15.1200
9 O7x O 22.2364 -13.9874
10 O6a O 24.4300 -15.1200
11 X Br 17.2676 -13.7200
12 X Cl 17.2676 -16.5200
BOND 13
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 8 10 2
12 1 11 1
13 2 12 1
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