ATOM 14
1 C1c C 27.5310 -14.7000
2 C1b C 26.3185 -15.3996
3 C6a C 28.7435 -15.3996
4 N1a N 27.5310 -13.3010
5 S3a S 25.1059 -14.7000
6 O6a O 29.9560 -14.7000
7 O6a O 28.7435 -16.7987
8 S3a S 23.8992 -15.3996
9 C1b C 22.6810 -14.7000
10 C1c C 21.4685 -15.3996
11 C6a C 20.2560 -14.7000
12 N1a N 21.4685 -16.7987
13 O6a O 19.0377 -15.3996
14 O6a O 20.2560 -13.3010
BOND 13
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 2
7 5 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 10 12 1
12 11 13 1
13 11 14 2
|