ATOM 15
1 C1z C 20.3000 -13.9300
2 C5x C 20.3000 -15.3300
3 C1x C 21.7000 -13.9300
4 N1y N 21.7000 -15.3300
5 O5x O 19.3101 -16.3199
6 S4a S 22.6899 -16.3199
7 O1d O 23.6799 -17.3099
8 O1d O 21.7000 -17.3098
9 O1d O 23.6798 -15.3300
10 N1b N 19.3101 -12.9401
11 O2a O 20.8358 -12.6366
12 C5a C 17.9646 -13.3006
13 C1a C 16.9873 -12.3230
14 O5a O 17.6043 -14.6458
15 C1a C 22.2427 -12.4508
BOND 15
1 1 2 1
2 1 3 1
3 2 4 1
4 3 4 1
5 2 5 2
6 4 6 1
7 6 7 1
8 6 8 2
9 6 9 2
10 1 10 1 #Up
11 1 11 1
12 10 12 1
13 12 13 1
14 12 14 2
15 11 15 1
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