ATOM 23
1 C8x C 19.9935 -18.7378
2 C8y C 19.9935 -20.1473
3 C8x C 21.1916 -20.8521
4 C8y C 22.4602 -20.1473
5 C8y C 22.4602 -18.7378
6 C8y C 21.1916 -18.0330
7 O1a O 21.1916 -16.6235
8 O1a O 18.7954 -20.8521
9 C7x C 23.6583 -18.0330
10 O7x O 24.8564 -18.7378
11 C1y C 26.0545 -18.0330
12 C1x C 27.2526 -18.7378
13 C1x C 28.4506 -18.0330
14 C1x C 29.6487 -18.7378
15 C1y C 29.6487 -20.1473
16 O1a O 30.8469 -20.8521
17 C1x C 28.4506 -20.8521
18 C1x C 27.2526 -20.1473
19 C1x C 26.0545 -20.8521
20 C1x C 24.8564 -20.1473
21 C1x C 23.6583 -20.8521
22 O6a O 23.6583 -16.6235
23 C1a C 26.0545 -16.6235
BOND 24
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 6 7 1
8 2 8 1
9 5 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1 #Down
17 15 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 4 1
23 9 22 2
24 11 23 1 #Up
|