ATOM 35
1 C1z C 26.6036 -16.9931
2 C1z C 25.3972 -17.6924
3 C1y C 26.6095 -15.5944
4 C1y C 27.8158 -17.6984
5 C1b C 26.7319 -18.3860
6 C1y C 24.1851 -16.9931
7 C1x C 24.6862 -18.9047
8 O2x O 26.0908 -18.9047
9 C1z C 27.8275 -14.8953
10 C1x C 25.4031 -14.8894
11 C1x C 29.0338 -17.0048
12 O7a O 28.4342 -19.0911
13 O7a O 27.2912 -19.5981
14 C1x C 24.1851 -15.5944
15 O7a O 22.9671 -17.6924
16 C1y C 27.8391 -13.4907
17 C1y C 29.0396 -15.6003
18 C1a C 29.0338 -14.0443
19 C7a C 29.6462 -19.7905
20 C7a C 26.5978 -20.8104
21 C7a C 21.7550 -16.9874
22 C1x C 28.9696 -12.6690
23 O2x O 26.6968 -12.6806
24 C1a C 30.2518 -15.4669
25 O6a O 30.8469 -19.0854
26 C1a C 29.6462 -21.1891
27 C1a C 27.2971 -22.0166
28 O6a O 25.1991 -20.8161
29 C1a C 20.5487 -17.6750
30 O6a O 21.7608 -15.5887
31 C1y C 28.5209 -11.3345
32 C1y C 27.1106 -11.3462
33 C2x C 28.9463 -9.9882
34 O2x O 26.6678 -10.0116
35 C2x C 27.8042 -9.1748
BOND 39
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1 #Up
7 2 8 1 #Down
8 3 9 1
9 3 10 1
10 4 11 1
11 4 12 1 #Down
12 5 13 1
13 6 14 1
14 6 15 1 #Down
15 9 16 1
16 9 17 1
17 9 18 1 #Down
18 12 19 1
19 13 20 1
20 15 21 1
21 16 22 1
22 16 23 1
23 17 24 1 #Down
24 19 25 2
25 19 26 1
26 20 27 1
27 20 28 2
28 21 29 1
29 21 30 2
30 22 31 1
31 23 32 1
32 31 33 1
33 32 34 1
34 33 35 2
35 7 8 1
36 10 14 1
37 11 17 1
38 31 32 1
39 34 35 1
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