ATOM 15
1 C2y C 14.7700 -17.5000
2 C2y C 14.7700 -18.9000
3 C2y C 15.9824 -19.6000
4 C2x C 17.1949 -18.9000
5 C1z C 17.1949 -17.5000
6 C1y C 15.9824 -16.8000
7 O1a O 15.9824 -15.4002
8 X Br 15.9824 -20.9998
9 O2a O 13.5576 -19.6000
10 C1a C 12.3621 -18.9096
11 X Br 13.5576 -16.8000
12 O1a O 18.4073 -18.2000
13 C1b C 18.1848 -16.5101
14 C3b C 19.5538 -16.8768
15 N3a N 20.9061 -17.2391
BOND 15
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 6 7 1 #Down
8 3 8 1
9 2 9 1
10 9 10 1
11 1 11 1
12 5 12 1 #Up
13 5 13 1
14 13 14 1
15 14 15 3
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