ATOM 16
1 C6a C 30.4756 -16.9379
2 C1b C 29.2641 -16.2421
3 O6a O 30.4692 -18.3426
4 O6a O 31.6870 -16.2355
5 C1b C 28.0463 -16.9379
6 C1b C 26.8349 -16.2421
7 C1b C 25.6236 -16.9379
8 C1b C 24.4056 -16.2421
9 C1b C 23.1944 -16.9379
10 C1b C 21.9764 -16.2421
11 C1b C 20.7651 -16.9379
12 C1b C 19.5537 -16.2421
13 C1b C 18.3359 -16.9379
14 C6a C 17.1244 -16.2421
15 O6a O 17.1308 -14.8374
16 O6a O 15.9130 -16.9445
BOND 15
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 2
15 14 16 1
|