ATOM 21
1 C1b C 23.5200 -18.9700
2 C1b C 24.7800 -18.2700
3 C1b C 22.3300 -18.2700
4 C1b C 25.9700 -18.9700
5 C1b C 21.1400 -18.9700
6 C1b C 27.1600 -18.2700
7 C1b C 19.8800 -18.2700
8 C1b C 28.4200 -18.9700
9 C1b C 18.6900 -18.9700
10 C1b C 29.6100 -18.2700
11 C5a C 17.5000 -18.2700
12 C1b C 30.8000 -18.9700
13 N1b N 16.2400 -18.9700
14 O5a O 17.5000 -16.8700
15 C1b C 32.0600 -18.2700
16 C1b C 33.2500 -18.9700
17 C1b C 34.4400 -18.2700
18 C1a C 35.7000 -18.9700
19 C1b C 15.0500 -18.2700
20 C1b C 13.8600 -18.9700
21 O1a O 12.6700 -18.2700
BOND 20
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 11 14 2
14 12 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 13 19 1
19 19 20 1
20 20 21 1
|