ATOM 16
1 C8x C 24.4143 -18.7975
2 C8y C 24.4143 -20.1999
3 C8x C 25.6318 -20.9011
4 C8x C 25.6318 -18.0964
5 C8y C 26.8420 -18.7975
6 C8y C 26.8359 -20.1999
7 N5x N 28.0474 -20.9062
8 C8x C 28.0594 -18.1015
9 C8y C 29.2709 -18.8079
10 C8y C 29.2582 -20.2065
11 C8x C 30.4632 -20.9169
12 C8y C 31.6807 -20.2285
13 C8x C 31.6935 -18.8298
14 C8x C 30.4885 -18.1195
15 N1a N 23.1961 -20.8939
16 N1a N 32.8851 -20.9293
BOND 18
1 7 10 2
2 9 8 2
3 8 5 1
4 5 4 1
5 4 1 2
6 1 2 1
7 2 3 2
8 3 6 1
9 9 10 1
10 10 11 1
11 11 12 2
12 12 13 1
13 13 14 2
14 14 9 1
15 5 6 2
16 2 15 1
17 6 7 1
18 12 16 1
|