ATOM 8
1 C1b C 27.6514 -19.9493
2 S4a S 29.0625 -19.1793
3 C6a C 26.4794 -19.2729
4 O1d O 28.5725 -17.6922
5 O1d O 29.6225 -20.6079
6 O1d O 30.3453 -18.5493
7 O6a O 25.3130 -19.9493
8 O6a O 26.4775 -17.8540
BOND 7
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 2
5 2 6 2
6 3 7 1
7 3 8 2
|