ATOM 18
1 C8x C 8.2600 -19.1100
2 C8y C 8.2600 -20.5100
3 C8x C 9.4724 -21.2100
4 C8x C 10.6849 -20.5100
5 C8y C 10.6849 -19.1100
6 C8x C 9.4724 -18.4100
7 C8y C 11.9160 -18.3990
8 C8x C 13.1212 -19.0947
9 C8x C 14.3335 -18.3946
10 C8x C 14.3335 -16.9946
11 C8x C 13.1283 -16.2989
12 C8x C 11.9159 -16.9990
13 C1c C 7.0476 -21.2100
14 C6a C 5.8521 -20.5196
15 C1b C 7.0475 -22.6098
16 O6a O 4.6647 -21.2051
17 O6a O 5.8520 -19.1103
18 C1a C 8.2768 -23.3197
BOND 19
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 2 13 1
15 13 14 1
16 13 15 1
17 14 16 1
18 14 17 2
19 15 18 1
|