ATOM 13
1 S3x S 14.9893 -14.4967
2 S3x S 13.5884 -14.4967
3 C1x C 13.1556 -15.8290
4 C1x C 14.2889 -16.6525
5 C1y C 15.4221 -15.8290
6 C1b C 16.6227 -16.5280
7 C1b C 17.8360 -15.8275
8 C1b C 19.0491 -16.5280
9 C1b C 20.2623 -15.8275
10 C5a C 21.4756 -16.5280
11 S2a S 22.6888 -15.8275
12 O5a O 21.4756 -17.9289
13 R R 24.0897 -15.8275
BOND 13
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 5 6 1 #Down
7 6 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 10 12 2
13 11 13 1
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