ATOM 17
1 C8y C 26.8321 -20.5174
2 C8y C 26.8321 -19.1678
3 C8y C 27.9946 -21.1891
4 C8y C 25.6636 -21.1891
5 C1y C 28.0004 -18.5077
6 C8x C 25.6695 -18.5018
7 C1x C 29.2213 -20.5291
8 C8x C 27.5746 -22.5387
9 N4x N 26.0836 -22.5387
10 C8x C 24.4951 -20.5174
11 C1y C 29.1629 -19.1737
12 C1x C 28.0004 -17.1581
13 C8x C 24.4951 -19.1678
14 N1y N 30.3197 -18.5077
15 C1x C 29.1629 -16.4921
16 C1x C 30.3197 -17.1581
17 C1a C 31.4940 -19.1737
BOND 20
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 2
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 11 14 1
14 12 15 1
15 14 16 1
16 14 17 1
17 7 11 1
18 8 9 1
19 10 13 2
20 15 16 1
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