ATOM 31
1 C8x C 13.0200 -20.8600
2 C8y C 13.0200 -22.2600
3 C8x C 14.2324 -22.9600
4 C8x C 15.4449 -22.2600
5 C8y C 15.4449 -20.8600
6 C8x C 14.2324 -20.1600
7 O1a O 11.8076 -22.9600
8 C1b C 16.6824 -20.1600
9 C1c C 17.8949 -20.8600
10 C5a C 19.1073 -20.1600
11 N1b N 20.3197 -20.8600
12 C1b C 21.5322 -20.1600
13 C1b C 22.7446 -20.8600
14 C1b C 23.9570 -20.1600
15 N1b N 25.1695 -20.8600
16 C1b C 26.3819 -20.1600
17 C1b C 27.5944 -20.8600
18 C1b C 28.8068 -20.1600
19 C1b C 30.0192 -20.8600
20 N1b N 31.2317 -20.1600
21 C1b C 32.4441 -20.8600
22 C1b C 33.6565 -20.1600
23 C1b C 34.8690 -20.8600
24 N1a N 36.0814 -20.1600
25 N1b N 17.8949 -22.2598
26 C5a C 19.1324 -22.9600
27 C1b C 20.3449 -22.2600
28 C1b C 21.5573 -22.9600
29 C1a C 22.7697 -22.2600
30 O5a O 19.1385 -24.3597
31 O5a O 19.1073 -18.7600
BOND 31
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 2 7 1
8 5 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 23 24 1
25 9 25 1 #Up
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 26 30 2
31 10 31 2
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