ATOM 24
1 C8y C 26.0267 -19.3119
2 C8y C 27.2861 -18.6122
3 C8y C 24.8372 -18.6122
4 C8x C 26.0267 -20.7112
5 C8y C 28.4755 -19.3119
6 C8x C 27.2861 -17.2128
7 C8y C 23.5778 -19.3119
8 O1a O 24.8372 -17.2128
9 C8y C 24.8372 -21.4808
10 C8y C 29.6650 -18.6122
11 O1a O 28.4755 -20.6412
12 C8y C 28.4755 -16.5132
13 C8x C 23.5778 -20.7112
14 C8x C 29.6650 -17.2128
15 O2a O 22.3838 -18.6093
16 C1a C 21.1735 -19.2950
17 C6a C 24.8553 -22.8900
18 O6a O 26.0726 -23.5721
19 O6a O 23.6480 -23.6078
20 O2a O 30.8949 -19.3157
21 C1a C 32.0839 -18.6226
22 C6a C 28.4756 -15.1201
23 O6a O 29.6989 -14.4138
24 O6a O 27.2740 -14.4262
BOND 25
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 2
12 7 13 1
13 10 14 2
14 9 13 2
15 12 14 1
16 7 15 1
17 15 16 1
18 9 17 1
19 17 18 2
20 17 19 1
21 10 20 1
22 20 21 1
23 12 22 1
24 22 23 1
25 22 24 2
|