ATOM 22
1 C8y C 23.7625 -19.1664
2 C8y C 23.6995 -17.7650
3 C8x C 22.5586 -17.0547
4 C8x C 21.3405 -17.7529
5 C8x C 21.3334 -19.1542
6 C8y C 22.5444 -19.8575
7 C8y C 29.8113 -21.2507
8 C8x C 29.8113 -19.8494
9 C8x C 28.5940 -19.1522
10 C8y C 27.3836 -19.8494
11 C8x C 27.3836 -21.2507
12 C8x C 28.5940 -21.9550
13 C5a C 26.1849 -19.1593
14 N1b N 24.9736 -19.8565
15 C1a C 22.5374 -21.2587
16 C1a C 24.9875 -17.0669
17 O5a O 26.1832 -17.7579
18 N1b N 31.0226 -21.9550
19 C5a C 32.2338 -21.2578
20 C1b C 33.4449 -21.9619
21 N1a N 34.6562 -21.2648
22 O5a O 32.1669 -19.8565
BOND 23
1 10 13 1
2 13 14 1
3 14 1 1
4 1 2 2
5 6 15 1
6 2 3 1
7 2 16 1
8 3 4 2
9 13 17 2
10 4 5 1
11 7 18 1
12 5 6 2
13 18 19 1
14 7 8 2
15 19 20 1
16 8 9 1
17 20 21 1
18 9 10 2
19 10 11 1
20 11 12 2
21 19 22 2
22 12 7 1
23 6 1 1
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