ATOM 43
1 C1z C 22.3874 -16.0010
2 C1y C 23.6072 -15.3066
3 C1y C 21.1733 -15.2832
4 C1y C 22.3815 -17.4018
5 C1x C 21.6754 -14.9738
6 C1z C 23.6187 -13.8999
7 C1y C 24.8269 -16.0187
8 C1z C 19.9478 -15.9836
9 C1y C 21.1150 -13.8766
10 C1x C 21.1617 -18.1079
11 O7x O 23.5896 -18.1196
12 O2x O 22.2065 -14.0399
13 C1y C 22.4108 -13.1879
14 C7a C 24.8328 -13.1938
15 C7x C 24.8152 -17.4252
16 O7a O 26.0409 -15.3240
17 C1y C 19.9418 -17.3960
18 C1x C 18.7280 -15.2832
19 C1a C 19.9361 -14.5769
20 O1a O 19.9652 -13.1647
21 O1a O 22.4223 -11.7756
22 O7a O 26.0526 -13.8999
23 O6a O 24.8328 -11.7814
24 O6a O 26.0293 -18.1430
25 C7a C 27.2491 -16.0187
26 C2y C 18.7280 -18.1022
27 C5x C 17.5081 -15.9836
28 C1a C 27.2724 -13.1879
29 C2b C 28.4689 -15.3124
30 O6a O 27.2548 -17.4309
31 C2y C 17.5081 -17.3960
32 C1a C 18.7280 -19.5146
33 O5x O 16.2826 -15.2773
34 C2c C 29.6887 -16.0127
35 O1a O 16.2826 -18.1022
36 C1d C 30.9084 -15.3066
37 C1a C 29.6945 -17.4252
38 O7a O 32.1224 -16.0070
39 C1a C 31.6087 -14.0809
40 C1a C 30.1965 -14.0809
41 C7a C 33.3423 -15.3007
42 C1a C 34.5621 -16.0010
43 O6a O 33.3423 -14.0982
BOND 47
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 7 15 1
15 7 16 1 #Up
16 8 17 1
17 8 18 1
18 8 19 1 #Up
19 9 20 1 #Up
20 13 21 1 #Down
21 14 22 1
22 14 23 2
23 15 24 2
24 16 25 1
25 17 26 1
26 18 27 1
27 22 28 1
28 25 29 1
29 25 30 2
30 26 31 2
31 26 32 1
32 27 33 2
33 29 34 2
34 31 35 1
35 34 36 1
36 34 37 1
37 36 38 1
38 36 39 1
39 36 40 1
40 38 41 1
41 41 42 1
42 41 43 2
43 6 12 1 #Up
44 9 13 1
45 10 17 1
46 11 15 1
47 27 31 1
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