ATOM 14
1 C8x C 23.4668 -18.9951
2 C8x C 23.4668 -20.3910
3 C8x C 24.6756 -21.0889
4 C8y C 25.8845 -20.3910
5 C8y C 25.8845 -18.9951
6 C8x C 24.6756 -18.2973
7 C8y C 27.1119 -18.2862
8 C8x C 28.3136 -18.9799
9 C8x C 29.5223 -18.2818
10 C8y C 29.5223 -16.8860
11 C8x C 28.3207 -16.1924
12 C8x C 27.1118 -16.8904
13 O1a O 30.7453 -16.1796
14 X Cl 27.0992 -21.0924
BOND 15
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 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 10 13 1
15 4 14 1
|