ATOM 27
1 C8x C 12.7400 -21.9800
2 C8y C 12.7400 -23.3800
3 C8x C 13.9524 -24.0800
4 C8x C 15.1649 -23.3800
5 C8y C 15.1649 -21.9800
6 C8x C 13.9524 -21.2800
7 N2b N 16.4024 -21.2800
8 N2b N 17.6149 -21.9800
9 C8y C 18.8273 -21.2800
10 C8y C 20.0418 -21.9812
11 C8y C 21.2542 -21.2812
12 C8x C 21.2542 -19.8812
13 C8x C 20.0397 -19.1800
14 C8y C 18.8273 -19.8800
15 C8x C 20.0418 -23.3812
16 C8x C 21.2542 -24.0812
17 C8x C 22.4666 -23.3812
18 C8x C 22.4666 -21.9812
19 O1a O 17.6169 -19.1812
20 N2b N 11.5276 -24.0800
21 N2b N 10.3321 -23.3896
22 C8y C 9.1447 -24.0751
23 C8x C 7.9535 -23.3871
24 C8x C 6.7410 -24.0869
25 C8x C 6.7408 -25.4869
26 C8x C 7.9320 -26.1749
27 C8x C 9.1445 -25.4751
BOND 30
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 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 9 14 1
16 10 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 11 18 1
21 14 19 1
22 2 20 1
23 20 21 2
24 21 22 1
25 22 23 2
26 23 24 1
27 24 25 2
28 25 26 1
29 26 27 2
30 22 27 1
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