ATOM 14
1 C1y C 25.3535 -22.4043
2 C1y C 26.5645 -21.6999
3 C1x C 24.1367 -21.6999
4 C1c C 25.3594 -23.8017
5 C1x C 26.5645 -20.3025
6 O7a O 27.7697 -22.4043
7 C1x C 24.1367 -20.3025
8 C1a C 24.1426 -24.5003
9 C1a C 26.5704 -24.5003
10 C1y C 25.3535 -19.6040
11 C7a C 28.9808 -21.6942
12 C1a C 25.3594 -18.2066
13 C1a C 30.1918 -22.3927
14 O6a O 28.9749 -20.2909
BOND 14
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 4 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 10 12 1 #Up
12 11 13 1
13 11 14 2
14 7 10 1
|