ATOM 43
1 C1y C 29.7639 -16.3786
2 C1z C 29.7580 -17.7394
3 C1y C 30.9402 -15.7039
4 C1y C 28.5933 -15.6923
5 C1z C 28.5703 -18.3909
6 C1x C 32.1051 -17.6810
7 C1a C 29.7466 -19.0888
8 C1z C 30.9345 -14.3199
9 C1x C 32.1107 -16.3901
10 C1x C 27.3482 -16.3612
11 O7a O 28.6049 -14.3083
12 C1y C 27.4055 -17.7105
13 C1x C 28.5703 -19.7461
14 C1a C 29.2464 -17.0301
15 O2x O 30.5078 -13.0110
16 C1x C 32.3126 -14.3199
17 C1a C 29.0358 -13.4274
18 C7a C 27.4113 -13.6107
19 C1z C 26.2476 -18.3794
20 C1x C 27.3939 -20.4150
21 C1y C 31.6206 -12.1980
22 C1x C 32.7393 -13.0110
23 C1a C 26.2118 -14.2911
24 O6a O 27.4229 -12.2211
25 C1y C 26.2407 -19.7346
26 C1x C 25.0758 -17.7105
27 C1a C 26.2349 -17.0186
28 C1d C 31.5975 -10.8082
29 C1z C 25.0758 -20.4092
30 C1x C 23.8996 -18.3794
31 C1a C 32.7855 -10.0933
32 C1a C 30.3924 -10.1336
33 O1a O 31.5803 -9.4244
34 C1y C 23.8996 -19.7346
35 C1a C 24.3839 -21.7803
36 C1a C 25.7327 -21.7803
37 O7a O 22.7175 -20.4035
38 C7a C 21.5584 -19.7287
39 C1b C 20.3879 -20.3976
40 O6a O 21.5584 -18.3794
41 C6a C 19.2230 -19.7230
42 O6a O 18.0524 -20.3861
43 O6a O 19.2301 -18.3678
BOND 47
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1 #Down
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1 #Up
11 5 12 1
12 5 13 1
13 5 14 1 #Up
14 8 15 1 #Up
15 8 16 1
16 8 17 1 #Down
17 11 18 1
18 12 19 1
19 13 20 1
20 15 21 1
21 16 22 1
22 18 23 1
23 18 24 2
24 19 25 1
25 19 26 1
26 19 27 1 #Up
27 21 28 1 #Up
28 25 29 1
29 26 30 1
30 28 31 1
31 28 32 1
32 28 33 1
33 29 34 1
34 29 35 1
35 29 36 1
36 34 37 1 #Down
37 37 38 1
38 38 39 1
39 38 40 2
40 39 41 1
41 41 42 1
42 41 43 2
43 6 9 1
44 10 12 1
45 20 25 1
46 21 22 1
47 30 34 1
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