ATOM 12
1 C2y C 13.6500 -16.1700
2 C2y C 13.6500 -17.5700
3 C5x C 14.8624 -18.2700
4 C2y C 16.0749 -17.5700
5 C2y C 16.0749 -16.1700
6 C5x C 14.8624 -15.4700
7 O5x O 14.8624 -14.0702
8 O5x O 14.8624 -19.6698
9 O1a O 12.4376 -15.4700
10 O1a O 12.4376 -18.2700
11 O1a O 17.3060 -15.4590
12 O1a O 17.3060 -18.2810
BOND 12
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 6 7 2
8 3 8 2
9 1 9 1
10 2 10 1
11 5 11 1
12 4 12 1
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