ATOM 13
1 C8x C 12.4600 -16.4500
2 C8x C 12.4600 -17.8500
3 C8x C 13.6724 -18.5500
4 C8x C 14.8849 -17.8500
5 C8y C 14.8849 -16.4500
6 C8x C 13.6724 -15.7500
7 C1b C 16.1224 -15.7500
8 N1b N 17.3349 -16.4500
9 C5a C 18.5473 -15.7500
10 C1b C 19.7597 -16.4500
11 C1b C 20.9722 -15.7500
12 X Cl 22.1846 -16.4500
13 O5a O 18.5473 -14.3500
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 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 9 13 2
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