ATOM 17
1 C1b C 19.3900 -15.7500
2 C1c C 19.3900 -17.1500
3 C5a C 20.6024 -17.8500
4 N1c N 21.8149 -17.1500
5 C1a C 20.6024 -15.0500
6 C1a C 23.0460 -17.8610
7 C1a C 21.8150 -15.7502
8 N1c N 18.1776 -17.8500
9 C5a C 16.9821 -17.1596
10 C1b C 18.1775 -19.2498
11 C1b C 16.9819 -19.9402
12 C1a C 15.7948 -19.2547
13 C2b C 15.7947 -17.8451
14 C2b C 14.6035 -17.1571
15 O5a O 16.9820 -15.7503
16 C1a C 13.4140 -17.8438
17 O5a O 20.6024 -19.2498
BOND 16
1 1 2 1
2 2 3 1
3 3 4 1
4 1 5 1
5 4 6 1
6 4 7 1
7 2 8 1
8 8 9 1
9 8 10 1
10 10 11 1
11 11 12 1
12 9 13 1
13 13 14 2
14 9 15 2
15 14 16 1
16 3 17 2
|