ATOM 15
1 C1y C 17.9555 -14.8112
2 C1y C 17.9555 -16.1815
3 O2x O 19.1973 -14.1291
4 C1b C 16.7192 -14.1291
5 C1y C 19.1973 -16.8519
6 O1a O 16.7192 -16.8519
7 C1y C 20.4391 -14.8112
8 O1a O 15.6350 -15.0094
9 C1y C 20.4391 -16.1815
10 O1a O 19.1914 -18.2223
11 O1a O 21.6753 -14.1291
12 N1b N 21.9553 -17.0619
13 C5a C 23.1582 -16.3237
14 C1a C 24.3922 -16.9928
15 O5a O 23.1582 -14.9237
BOND 15
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1 #Down
10 7 11 1 #Either
11 9 12 1 #Down
12 7 9 1
13 12 13 1
14 13 14 1
15 13 15 2
|