ATOM 20
1 C8y C 26.1600 -18.2322
2 C8x C 26.5253 -16.8094
3 C8x C 27.9251 -16.8110
4 C8x C 28.4274 -18.1215
5 N4y N 27.3339 -18.9954
6 C8y C 20.1156 -18.9479
7 C8x C 20.1156 -20.3496
8 C8x C 18.8976 -21.0540
9 C8x C 17.6870 -20.3496
10 C8x C 17.6870 -18.9479
11 C8x C 18.8976 -18.2505
12 N1b N 21.3272 -18.2505
13 C5a C 22.5387 -18.9408
14 C1c C 23.7433 -18.2434
15 C5a C 24.9549 -18.9337
16 O5a O 22.5417 -20.3426
17 O5a O 24.8880 -20.3355
18 C1a C 27.3324 -20.3955
19 C3b C 23.7402 -16.8416
20 N3a N 23.7363 -15.4399
BOND 21
1 9 10 1
2 10 11 2
3 11 6 1
4 6 12 1
5 1 2 2
6 12 13 1
7 2 3 1
8 13 14 1
9 3 4 2
10 14 15 1
11 15 1 1
12 4 5 1
13 13 16 2
14 5 1 1
15 15 17 2
16 6 7 2
17 5 18 1
18 14 19 1
19 7 8 1
20 8 9 2
21 19 20 3
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