ATOM 11
1 C8y C 9.4500 -18.4100
2 N4x N 9.8700 -19.7400
3 N5x N 11.2700 -19.7400
4 C8y C 11.6900 -18.4100
5 N5x N 10.5700 -17.5700
6 S2a S 12.8800 -17.7100
7 C1b C 14.0700 -18.4100
8 C6a C 15.2600 -17.7100
9 O6a O 16.4500 -18.4100
10 O6a O 15.2600 -16.3100
11 C1a C 8.2600 -17.7100
BOND 11
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 1 5 2
6 6 7 1
7 6 4 1
8 7 8 1
9 8 9 1
10 8 10 2
11 11 1 1
|