ATOM 31
1 C8x C 23.1980 -22.4863
2 C8y C 23.1980 -19.6781
3 C8y C 24.4107 -20.3837
4 C8y C 24.4048 -21.7878
5 C1y C 25.6186 -22.4913
6 C1x C 25.6306 -19.6833
7 C1y C 26.8445 -20.3940
8 C1y C 26.8418 -21.8022
9 C7x C 28.1807 -22.2377
10 O7x O 29.0062 -21.0986
11 C1x C 28.1848 -19.9636
12 C8y C 21.9783 -21.7878
13 C8y C 21.9848 -20.3883
14 O2x O 20.6553 -19.9517
15 C1x C 19.8319 -21.0746
16 O2x O 20.6450 -22.2118
17 C8y C 25.6101 -23.8953
18 C8x C 24.3909 -24.5856
19 C8y C 24.3823 -25.9895
20 C8y C 25.5949 -26.6955
21 C8y C 26.8159 -26.0044
22 C8x C 26.8245 -24.6005
23 O2a O 28.0214 -26.7104
24 O2a O 25.5862 -28.0995
25 O2a O 23.1611 -26.6806
26 C1a C 29.2426 -26.0195
27 C1a C 21.9485 -25.9746
28 O2a O 23.1961 -18.2742
29 O6a O 28.6100 -23.5742
30 C1a C 24.4052 -17.5740
31 C1a C 26.7917 -28.8055
BOND 35
1 15 16 1
2 16 12 1
3 2 13 2
4 5 17 1 #Down
5 12 1 2
6 1 4 1
7 3 2 1
8 7 8 1
9 17 18 2
10 18 19 1
11 19 20 2
12 20 21 1
13 21 22 2
14 22 17 1
15 8 9 1
16 21 23 1
17 9 10 1
18 20 24 1
19 10 11 1
20 19 25 1
21 11 7 1
22 23 26 1
23 3 4 2
24 25 27 1
25 4 5 1
26 2 28 1
27 5 8 1
28 9 29 2
29 7 6 1
30 6 3 1
31 12 13 1
32 13 14 1
33 28 30 1
34 14 15 1
35 24 31 1
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