ATOM 19
1 C8y C 12.2500 -18.3400
2 C8y C 12.2500 -19.7400
3 C8x C 13.4624 -20.4400
4 C8y C 14.6749 -19.7400
5 C8y C 14.6749 -18.3400
6 C8x C 13.4624 -17.6400
7 X Cl 11.0376 -17.6400
8 X Cl 11.0376 -20.4400
9 X Cl 15.9060 -20.4510
10 N2b N 15.9060 -17.6290
11 N2b N 17.1112 -18.3247
12 S2a S 18.2935 -17.6419
13 C8y C 19.4875 -18.3312
14 C8x C 19.4876 -19.7397
15 C8x C 20.7001 -20.4396
16 C8y C 21.9125 -19.7395
17 C8x C 21.9123 -18.3309
18 C8x C 20.6998 -17.6311
19 X Cl 23.1234 -20.4384
BOND 20
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 1 7 1
8 2 8 1
9 4 9 1
10 5 10 1
11 10 11 2
12 11 12 1
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 13 18 1
20 16 19 1
|