ATOM 31
1 C1z C 25.0018 -17.0447
2 C1z C 23.7946 -17.7445
3 C1y C 25.0075 -15.6393
4 C1y C 26.2147 -17.7445
5 C1b C 24.9901 -18.4385
6 C1x C 23.0891 -18.9516
7 O2x O 24.4944 -18.9576
8 C1x C 22.5817 -17.0447
9 C1z C 26.2263 -14.9395
10 C1x C 23.8005 -14.9395
11 C1x C 27.4335 -17.0564
12 O7a O 26.9030 -19.1384
13 O7a O 25.6899 -19.6515
14 C1x C 22.5817 -15.6393
15 C1y C 27.4394 -15.6510
16 C1b C 25.5091 -13.7207
17 C1a C 26.9145 -13.7207
18 C7a C 28.1044 -19.8439
19 C7a C 24.9960 -20.8644
20 C1a C 28.6582 -14.9512
21 C1b C 26.2089 -12.5078
22 C1a C 28.0927 -21.2435
23 O6a O 29.3173 -19.1615
24 C1a C 25.6899 -22.0658
25 O6a O 23.5964 -20.8644
26 C2y C 25.4974 -11.3590
27 C2x C 24.0978 -11.3647
28 C1x C 25.8590 -9.9360
29 C7x C 23.5964 -10.0585
30 O7x O 24.6869 -9.1896
31 O6a O 22.2435 -9.7027
BOND 34
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1 #Up
6 2 7 1 #Down
7 2 8 1
8 3 9 1
9 3 10 1
10 4 11 1
11 4 12 1 #Down
12 5 13 1
13 8 14 1
14 9 15 1
15 9 16 1 #Up
16 9 17 1 #Down
17 12 18 1
18 13 19 1
19 15 20 1 #Down
20 16 21 1
21 18 22 1
22 18 23 2
23 19 24 1
24 19 25 2
25 21 26 1
26 26 27 2
27 26 28 1
28 27 29 1
29 28 30 1
30 29 31 2
31 6 7 1
32 10 14 1
33 11 15 1
34 29 30 1
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