ATOM 22
1 N1y N 9.6625 -4.9262
2 C5a C 9.3968 -4.1411
3 N1b N 8.5878 -3.9839
4 O5a O 9.9435 -3.5209
5 C1x C 9.1843 -5.6027
6 C1x C 9.6785 -6.2685
7 C8y C 10.4534 -5.1768
8 C8y C 10.4628 -6.0005
9 C8x C 11.1804 -6.4033
10 C8x C 11.1616 -4.7558
11 C8y C 11.8822 -5.1613
12 C8y C 11.8932 -5.9869
13 N4y N 12.6806 -6.2326
14 C8x C 13.1614 -5.5598
15 C8x C 12.6667 -4.8948
16 C1a C 12.9471 -7.0172
17 C8y C 7.8766 -4.4020
18 C8x C 7.1615 -3.9955
19 C8x C 6.4502 -4.4136
20 C8x C 6.4567 -5.2386
21 N5x N 7.1744 -5.6455
22 C8x C 7.8856 -5.2274
BOND 25
1 2 3 1
2 2 4 2
3 7 8 2
4 8 9 1
5 9 12 2
6 11 10 2
7 10 7 1
8 11 12 1
9 12 13 1
10 13 14 1
11 14 15 2
12 15 11 1
13 13 16 1
14 3 17 1
15 1 2 1
16 1 5 1
17 5 6 1
18 6 8 1
19 7 1 1
20 17 18 2
21 18 19 1
22 19 20 2
23 20 21 1
24 21 22 2
25 22 17 1
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