ATOM 12
1 C8x C 18.7854 -16.6459
2 C8x C 18.7699 -18.0469
3 C8y C 19.9764 -18.7574
4 C8y C 21.1984 -18.0739
5 C8x C 21.2139 -16.6728
6 C8y C 20.0074 -15.9553
7 C4a C 20.0230 -14.5543
8 O2a O 22.3974 -18.7889
9 O1a O 19.9608 -20.1584
10 O4a O 21.2450 -13.8708
11 C1b C 23.6134 -18.1082
12 C1a C 24.8173 -18.8193
BOND 12
1 6 1 2
2 6 7 1
3 1 2 1
4 4 8 1
5 2 3 2
6 3 9 1
7 3 4 1
8 7 10 2
9 4 5 2
10 8 11 1
11 5 6 1
12 11 12 1
|