ATOM 19
1 C8x C 19.6150 -16.9636
2 C8x C 19.6150 -18.3650
3 C8x C 20.8285 -19.0657
4 C8y C 22.0422 -18.3650
5 C8y C 22.0422 -16.9636
6 C8x C 20.8285 -16.2629
7 C2y C 23.3751 -18.7980
8 C2y C 24.1988 -17.6643
9 C1y C 23.3751 -16.5306
10 C8y C 25.5708 -17.6643
11 C8x C 26.2715 -18.8779
12 C8x C 27.6729 -18.8779
13 C8y C 28.3736 -17.6643
14 C8x C 27.6729 -16.4507
15 C8x C 26.2715 -16.4507
16 C1a C 23.8066 -15.2025
17 C1b C 23.8066 -20.1261
18 C1a C 25.1874 -20.4196
19 O1a O 29.7498 -17.6639
BOND 21
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 2
9 8 9 1
10 5 9 1
11 8 10 1
12 10 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 10 15 1
18 9 16 1 #Up
19 7 17 1
20 17 18 1
21 13 19 1
|