ATOM 19
1 C8y C 28.5169 -17.0538
2 C8y C 28.5169 -18.4573
3 C8x C 29.7324 -19.1591
4 C8x C 30.9479 -18.4573
5 C8y C 30.9479 -17.0538
6 C8x C 29.7324 -16.3521
7 O2a O 27.3015 -16.3521
8 O2a O 27.3015 -19.1591
9 C1a C 26.1030 -18.4670
10 C1a C 26.1030 -17.0442
11 C1b C 32.1821 -16.3410
12 C1b C 33.3904 -17.0385
13 N2b N 34.5756 -16.3540
14 C2y C 35.7726 -17.0450
15 C1x C 36.1642 -18.3969
16 C1x C 37.5728 -18.4361
17 C1x C 38.0454 -17.1086
18 N1y N 36.9289 -16.2489
19 C1a C 36.9677 -14.8624
BOND 20
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 2 8 1
9 8 9 1
10 7 10 1
11 5 11 1
12 11 12 1
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 14 18 1
20 18 19 1
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