ATOM 20
1 C8y C 10.6400 -22.1900
2 C8y C 10.6400 -20.7900
3 C8y C 9.4500 -20.0900
4 C8x C 8.1900 -20.7900
5 C8x C 8.1900 -22.1900
6 C8x C 9.4500 -22.8900
7 N1c N 11.8300 -20.0900
8 C5a C 13.0900 -20.7900
9 C1b C 14.2800 -20.0900
10 O2a O 15.4700 -20.7900
11 C1a C 16.7300 -20.0900
12 O5a O 13.0900 -22.1900
13 N1y N 11.8300 -18.6900
14 C7x C 12.9500 -17.8500
15 O7x O 12.5300 -16.5900
16 C1x C 11.1300 -16.5900
17 C1x C 10.7100 -17.8500
18 O6a O 14.2800 -18.2700
19 C1a C 11.8300 -22.8900
20 C1a C 9.4500 -18.6900
BOND 21
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 2 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 8 12 2
13 7 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 13 17 1
19 14 18 2
20 1 19 1
21 3 20 1
|