ATOM 33
1 C1y C 28.3253 -18.7077
2 C8y C 29.5325 -18.0107
3 C8y C 25.9131 -18.6960
4 C8y C 25.9074 -20.0944
5 O2x O 27.1251 -18.0085
6 C8x C 24.7070 -18.0027
7 C8y C 24.7070 -20.7876
8 C1x C 27.1075 -20.7935
9 C8y C 23.5010 -18.6960
10 O2a O 24.7130 -22.1802
11 C8x C 23.5010 -20.0944
12 C1x C 28.3195 -20.1001
13 O1a O 22.2949 -18.0027
14 C1y C 23.3029 -22.9958
15 O2x O 22.0969 -22.2968
16 C1y C 23.3029 -24.3884
17 C1y C 20.8851 -22.9958
18 C1y C 22.0969 -25.0817
19 O1a O 24.5090 -25.0817
20 C1y C 20.8851 -24.3884
21 C1b C 19.6790 -22.2968
22 O1a O 22.0969 -26.4801
23 O1a O 19.6790 -25.0876
24 O1a O 18.4729 -22.9901
25 C8x C 29.5373 -16.6277
26 C8x C 30.7374 -18.7252
27 C8y C 30.7491 -15.9343
28 C8x C 32.0192 -18.0318
29 C8y C 31.9552 -16.6393
30 O2a O 30.7548 -14.5359
31 O2a O 33.1612 -15.9459
32 C1a C 31.9668 -13.8484
33 C1a C 34.3673 -16.6451
BOND 36
1 7 10 1
2 7 11 2
3 8 12 1
4 9 13 1
5 14 10 1 #Up
6 14 15 1
7 14 16 1
8 15 17 1
9 16 18 1
10 16 19 1 #Down
11 17 20 1
12 17 21 1 #Up
13 18 22 1 #Up
14 20 23 1 #Down
15 21 24 1
16 1 12 1
17 9 11 1
18 18 20 1
19 1 2 1 #Down
20 3 4 2
21 3 5 1
22 3 6 1
23 4 7 1
24 4 8 1
25 5 1 1
26 6 9 2
27 2 25 1
28 2 26 2
29 25 27 2
30 26 28 1
31 27 29 1
32 27 30 1
33 29 31 1
34 30 32 1
35 31 33 1
36 28 29 2
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