ATOM 23
1 O2a O 29.2703 -19.6471
2 C1y C 28.0035 -20.2564
3 O2x O 26.8112 -19.5661
4 C1y C 28.0035 -21.6483
5 C1y C 25.6003 -20.2564
6 C1y C 26.8112 -22.3443
7 O1a O 29.2086 -22.3443
8 C1y C 25.6003 -21.6483
9 C6a C 24.3954 -19.5661
10 O1a O 26.8172 -23.7362
11 O1a O 24.3954 -22.3501
12 O6a O 24.4011 -18.1742
13 O6a O 23.1901 -20.2564
14 C8x C 31.7083 -18.2421
15 C8y C 30.4856 -17.5344
16 C8x C 32.9238 -17.5402
17 C8y C 30.4913 -16.1192
18 C8y C 29.2687 -18.2362
19 C8x C 32.9295 -16.1309
20 C8x C 31.7200 -15.4232
21 C8x C 29.2687 -15.4174
22 C8x C 28.0462 -17.5344
23 C8x C 28.0462 -16.1192
BOND 25
1 3 5 1
2 4 6 1
3 4 7 1 #Down
4 5 8 1
5 5 9 1 #Up
6 6 10 1 #Up
7 8 11 1 #Down
8 9 12 1
9 9 13 2
10 6 8 1
11 2 1 1 #Up
12 2 3 1
13 2 4 1
14 14 15 1
15 14 16 2
16 15 17 2
17 15 18 1
18 16 19 1
19 17 20 1
20 17 21 1
21 18 22 2
22 21 23 2
23 19 20 2
24 22 23 1
25 18 1 1
|