ATOM 20
1 C8y C 14.4132 -15.4406
2 C8y C 14.4072 -16.8412
3 N4y N 15.6328 -14.7403
4 C8x C 13.1992 -14.7346
5 C8y C 15.6212 -17.5474
6 C8x C 13.1992 -17.5415
7 C8y C 16.8466 -15.4523
8 O2a O 15.6386 -13.3457
9 C8x C 11.9855 -15.4406
10 C8x C 16.8408 -16.8529
11 O5x O 15.6152 -18.9422
12 C8x C 11.9855 -16.8412
13 C1b C 18.0605 -14.7579
14 C1b C 19.2626 -15.4640
15 C1b C 20.4764 -14.7696
16 C1b C 21.6844 -15.4757
17 C1b C 22.8983 -14.7813
18 C1b C 24.1004 -15.4873
19 C1a C 25.3143 -14.7930
20 C1a C 16.8220 -12.6692
BOND 21
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 2
11 6 12 2
12 7 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 7 10 2
20 9 12 1
21 8 20 1
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