ATOM 20
1 C8y C 15.7964 -19.0974
2 C5a C 17.0324 -18.4100
3 C8y C 18.2449 -19.1100
4 C8x C 18.2449 -20.5098
5 C8x C 19.4573 -21.2098
6 C8y C 20.6697 -20.5098
7 C8x C 20.6697 -19.1100
8 C8x C 19.4573 -18.4100
9 O5a O 17.0437 -17.0104
10 C8y C 14.5510 -18.5187
11 C8y C 13.6158 -19.5244
12 O2x O 14.2832 -20.7245
13 C8y C 15.6309 -20.4606
14 C8x C 14.1398 -17.1805
15 C8x C 12.7752 -16.8675
16 C8x C 11.8401 -17.8731
17 C8x C 12.2513 -19.2113
18 C1b C 16.6346 -21.3940
19 C1a C 16.3171 -22.7773
20 O1a O 21.8674 -21.2014
BOND 22
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 6 7 1
7 7 8 2
8 3 8 1
9 2 9 2
10 1 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 1 13 2
15 10 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 11 17 2
20 13 18 1
21 18 19 1
22 6 20 1
|