ATOM 32
1 C8y C 22.6100 -10.5000
2 C8x C 22.6100 -11.9000
3 C8x C 23.8224 -12.6000
4 C8y C 25.0349 -11.9000
5 C8x C 25.0349 -10.5000
6 C8x C 23.8224 -9.8000
7 C1a C 26.2660 -12.6110
8 S4a S 21.3976 -9.8000
9 N1b N 20.2021 -10.4904
10 C5a C 19.0147 -9.8049
11 N1b N 17.8235 -10.4929
12 C8y C 16.6340 -9.8062
13 O5a O 19.0145 -8.4002
14 C8x C 16.6338 -8.4002
15 C8x C 15.4213 -7.7004
16 C8x C 14.2090 -8.4005
17 C8x C 14.2091 -9.8065
18 C8y C 15.4216 -10.5063
19 O3c O 22.3875 -8.8101
20 O3c O 20.4076 -8.8101
21 N1b N 15.4217 -11.8998
22 C2c C 14.1930 -12.6094
23 N1b N 12.9893 -11.9144
24 S0 S 14.1932 -13.9999
25 P1b P 11.8062 -12.5976
26 O2b O 10.5938 -13.2976
27 O3b O 12.5130 -13.8221
28 O2b O 11.1134 -11.3973
29 C1b C 9.7301 -11.3973
30 C1a C 9.0355 -10.1944
31 C1b C 9.3647 -12.5878
32 C1a C 8.1585 -13.2841
BOND 33
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 4 7 1
8 1 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 10 13 2
14 12 14 2
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 12 18 1
20 8 19 2
21 8 20 2
22 18 21 1
23 21 22 1
24 22 23 1
25 22 24 2
26 23 25 1
27 25 26 1
28 25 27 2
29 25 28 1
30 28 29 1
31 29 30 1
32 26 31 1
33 31 32 1
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