ATOM 18
1 O2b O 12.8100 -15.8200
2 C1b C 14.0224 -15.1200
3 C5a C 15.2349 -15.8200
4 C1c C 16.4473 -15.1200
5 C1c C 17.6597 -15.8200
6 C1c C 18.8722 -15.1200
7 C1c C 20.0846 -15.8200
8 C1b C 21.2970 -15.1200
9 O1a O 22.5095 -15.8200
10 O1a O 20.0846 -17.2200
11 O1a O 17.6597 -17.2199
12 O1a O 16.4473 -13.7200
13 O1a O 18.8722 -13.7203
14 O5a O 15.2349 -17.2198
15 P1b P 11.4100 -15.8200
16 O1c O 10.0100 -15.8200
17 O1c O 11.4100 -14.4200
18 O1c O 11.4100 -17.2200
BOND 17
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 7 10 1 #Up
10 5 11 1 #Up
11 4 12 1 #Up
12 6 13 1 #Down
13 3 14 2
14 1 15 1
15 15 16 1
16 15 17 2
17 15 18 1
|