ATOM 12
1 C8y C 28.1021 -18.8522
2 O2x O 28.5388 -17.5186
3 N4x N 27.4005 -16.6909
4 C8y C 26.2624 -17.5186
5 C8x C 26.6990 -18.8522
6 O5x O 24.9273 -17.0868
7 C1y C 28.9162 -19.9755
8 C1x C 28.3523 -21.2387
9 C1x C 29.1767 -22.3759
10 N1x N 30.5737 -22.2305
11 C1x C 31.1378 -20.9672
12 C1x C 30.3133 -19.8301
BOND 13
1 1 2 1
2 4 6 2
3 2 3 1
4 3 4 1
5 4 5 1
6 5 1 2
7 1 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 7 12 1
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