ATOM 37
1 C8y C 20.6094 -12.8962
2 C1x C 22.0191 -12.8962
3 C1y C 23.0059 -13.8830
4 C1y C 23.0059 -15.2927
5 C1y C 22.0191 -16.2795
6 C8y C 20.6094 -16.2795
7 C8y C 19.6226 -15.2927
8 C8y C 19.6226 -13.8830
9 C8x C 20.2570 -11.5569
10 C8y C 18.8472 -11.2045
11 C8y C 17.8604 -12.1913
12 C8y C 18.2129 -13.5306
13 O2x O 18.2129 -9.9358
14 C1x C 16.8736 -10.1472
15 O2x O 16.5917 -11.5569
16 C8y C 18.2129 -15.6452
17 C8y C 17.8604 -17.0549
18 C8y C 18.8472 -18.0417
19 C8x C 20.1865 -17.6893
20 O2a O 18.4948 -19.3810
21 C1a C 17.1556 -19.7335
22 O2a O 16.5212 -17.4073
23 C1a C 16.0983 -18.7466
24 O2x O 17.0146 -14.2354
25 O2a O 17.0146 -15.2222
26 C1a C 15.9563 -16.2771
27 C1a C 24.2747 -13.3191
28 O7x O 22.5830 -17.5483
29 C7x C 22.5830 -18.9483
30 O6a O 23.7955 -19.6483
31 C1z C 20.6706 -20.9783
32 C1x C 12.9322 -16.5454
33 C1y C 13.9122 -20.7454
34 O1a O 21.8830 -21.6783
35 C1a C 20.6706 -22.3783
36 C1a C 13.2122 -21.9578
37 C1a C 24.2183 -15.9927
BOND 41
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 1 1 #Down
9 1 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 8 12 2
14 10 13 1
15 13 14 1
16 14 15 1
17 11 15 1
18 7 16 2
19 16 17 1
20 17 18 2
21 18 19 1
22 6 19 2
23 18 20 1
24 20 21 1
25 17 22 1
26 22 23 1
27 24 12 1
28 25 16 1
29 25 26 1
30 3 27 1 #Down
31 5 28 1 #Up
32 28 29 1
33 29 30 2
34 29 31 1
35 24 32 1
36 32 33 1
37 33 31 1
38 31 34 1 #Down
39 31 35 1 #Up
40 33 36 1 #Down
41 4 37 1 #Down
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