 ATOM 14
1 C8y C 24.4292 -17.9200
2 C8y C 23.0215 -17.9200
3 N4x N 25.2468 -19.0532
4 N5x N 25.2468 -16.7868
5 C8x C 22.1920 -16.7868
6 N5x N 22.1920 -19.0532
7 C8y C 26.5788 -18.6093
8 C8y C 26.5788 -17.2307
9 S2x S 20.8543 -17.2307
10 C8x C 20.8543 -18.6093
11 C8x C 27.7994 -19.3102
12 C8x C 27.7994 -16.5240
13 C8x C 29.0145 -18.6093
14 C8x C 29.0145 -17.2307
BOND 16
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 6 10 2
10 7 11 1
11 8 12 1
12 11 13 2
13 12 14 2
14 7 8 2
15 9 10 1
16 13 14 1
|