ATOM 29
1 C8y C 9.6600 -17.5000
2 C8x C 9.6600 -18.9000
3 C8y C 10.8724 -19.6000
4 C8x C 12.0849 -18.9000
5 C8y C 12.0849 -17.5000
6 C8x C 10.8724 -16.8000
7 C1a C 8.4476 -16.8000
8 C1a C 10.8724 -20.9998
9 C5a C 13.3224 -16.8000
10 N1c N 14.5349 -17.5000
11 N1b N 15.7473 -16.8000
12 C5a C 16.9597 -17.5000
13 O5a O 13.3286 -15.4003
14 C1d C 14.5349 -19.1098
15 C1a C 15.7661 -19.8208
16 C1a C 13.3413 -19.7990
17 C1a C 14.5349 -20.5098
18 C8y C 18.1573 -16.8085
19 O5a O 16.9598 -18.8999
20 C8y C 19.3456 -17.4945
21 C8y C 20.5580 -16.7945
22 C8y C 20.5580 -15.3945
23 C8x C 19.3697 -14.7085
24 C8x C 18.1573 -15.4085
25 C1a C 19.3457 -18.8998
26 C1x C 21.7704 -17.4945
27 C1x C 22.9829 -16.7945
28 C1x C 22.9829 -15.3945
29 O2x O 21.7705 -14.6945
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 1 7 1
8 3 8 1
9 5 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 9 13 2
14 10 14 1
15 14 15 1
16 14 16 1
17 14 17 1
18 12 18 1
19 12 19 2
20 18 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 18 24 1
26 20 25 1
27 21 26 1
28 26 27 1
29 27 28 1
30 28 29 1
31 22 29 1
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