ATOM 22
1 C8x C 22.4076 -18.5083
2 C8x C 22.4076 -19.9040
3 C8x C 23.6162 -20.6018
4 C8y C 24.8251 -19.9040
5 C8y C 24.8251 -18.5083
6 C8x C 23.6162 -17.8103
7 N4x N 26.1525 -20.3353
8 C8y C 26.9729 -19.2062
9 C8y C 26.1525 -18.0770
10 C1y C 28.3610 -19.0603
11 N1y N 28.9286 -17.7850
12 C1x C 28.1083 -16.6559
13 C1x C 26.7202 -16.8018
14 C1x C 29.1768 -20.1833
15 C1y C 30.5650 -20.0375
16 C1b C 31.2629 -21.2462
17 C1y C 31.2629 -18.8288
18 C1x C 30.3204 -17.6388
19 C2b C 32.6564 -18.8288
20 C2a C 33.3532 -17.6219
21 C4a C 32.6626 -21.2462
22 O4a O 33.3624 -22.4583
BOND 25
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 14 15 1
18 15 16 1
19 15 17 1
20 11 18 1
21 18 17 1
22 17 19 1 #Down
23 19 20 2
24 16 21 1
25 21 22 2
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