ATOM 13
1 C8y C -0.1655 0.0931
2 C5a C 0.5517 0.5138
3 C8y C -0.1655 -0.7345
4 C8x C -0.8828 0.5103
5 C1b C 1.2655 0.0966
6 O5a O 0.5483 1.3379
7 C8x C -0.8828 -1.1448
8 N1a N 0.5483 -1.1483
9 C8y C -1.5931 0.0931
10 C1b C 1.9828 0.5103
11 C8x C -1.5931 -0.7345
12 O1a O -2.3103 0.5103
13 N1a N 2.6931 0.1000
BOND 13
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 7 11 1
11 9 12 1
12 10 13 1
13 9 11 2
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