ATOM 16
1 C8x C 19.3900 -15.4700
2 C8x C 19.3900 -16.8700
3 C8y C 20.6024 -17.5700
4 C8y C 21.8149 -16.8700
5 C8y C 21.8149 -15.4700
6 C8y C 20.6024 -14.7700
7 N4x N 23.1464 -17.3026
8 C8y C 23.9693 -16.1700
9 S2x S 23.1464 -15.0374
10 O5x O 25.3400 -16.1700
11 C1c C 20.6024 -13.3702
12 C1b C 19.3732 -12.6603
13 O1a O 21.7980 -12.6798
14 N1b N 18.1692 -13.3554
15 C1a C 16.9863 -12.6723
16 O1a O 20.6024 -18.9698
BOND 17
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 7 8 1
9 8 9 1
10 5 9 1
11 8 10 2
12 6 11 1
13 11 12 1
14 11 13 1
15 12 14 1
16 14 15 1
17 3 16 1
|