ATOM 14
1 C8y C 27.6253 -16.2367
2 C8y C 27.6253 -17.6256
3 N4y N 28.8373 -18.3236
4 C8y C 30.0350 -17.6256
5 N5x N 30.0350 -16.2367
6 N5x N 28.8373 -15.5456
7 O5x O 26.4237 -18.3243
8 S2a S 31.2374 -18.3227
9 C1d C 26.4237 -15.5451
10 C1a C 26.4244 -14.1560
11 C1a C 25.2215 -16.2353
12 C1a C 25.1763 -14.6994
13 N1a N 28.8408 -19.7143
14 C1a C 32.4684 -17.6149
BOND 14
1 1 2 1
2 2 7 2
3 2 3 1
4 4 8 1
5 3 4 1
6 4 5 2
7 1 9 1
8 5 6 1
9 9 10 1
10 6 1 2
11 9 11 1
12 9 12 1
13 3 13 1
14 8 14 1
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