ATOM 18
1 C8y C 23.8447 -18.7305
2 N1b N 25.0770 -19.4430
3 C8y C 22.6183 -19.4487
4 C8y C 23.8447 -17.3112
5 C5a C 26.3033 -18.7245
6 C8x C 21.3918 -18.7305
7 C1a C 22.6241 -20.8620
8 C8x C 22.6183 -16.6046
9 C1a C 25.0653 -16.6046
10 C1y C 27.5298 -19.4430
11 O5a O 26.2916 -17.6499
12 C8x C 21.3918 -17.3112
13 N1y N 27.5182 -20.8678
14 C1x C 28.7621 -18.7421
15 C1x C 28.7445 -21.5862
16 C1a C 26.2976 -21.5512
17 C1x C 29.9885 -19.4604
18 C1x C 29.9768 -20.8795
BOND 19
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 1
7 4 8 2
8 4 9 1
9 5 10 1
10 5 11 2
11 6 12 2
12 10 13 1
13 10 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 15 18 1
18 8 12 1
19 17 18 1
|