ATOM 12
1 C8x C 19.5300 -17.8500
2 C8y C 19.5300 -19.2500
3 C8x C 20.7424 -19.9500
4 C8x C 21.9549 -19.2500
5 C8y C 21.9549 -17.8500
6 C8y C 20.7424 -17.1500
7 N1a N 20.7424 -15.7502
8 O2a O 23.1860 -17.1390
9 C1a C 24.3912 -17.8347
10 N2b N 18.3176 -19.9500 #+
11 O3a O 16.9821 -19.2596 #-
12 O3a O 18.3175 -21.3498
BOND 12
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 6 7 1
8 5 8 1
9 8 9 1
10 2 10 1
11 10 11 1
12 10 12 2
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