ATOM 28
1 C8y C 34.2659 -21.0937
2 C8x C 34.2659 -22.5006
3 C8x C 35.4843 -23.2041
4 C8x C 36.7028 -22.5006
5 C8x C 36.7028 -21.0937
6 C8x C 35.4843 -20.3902
7 O2a O 33.0475 -20.3902
8 C8y C 31.8461 -21.0840
9 C8x C 30.6528 -20.3951
10 C8y C 29.4344 -21.0987
11 C8x C 29.4345 -22.5057
12 C8x C 30.6277 -23.1945
13 C8x C 31.8461 -22.4910
14 C1b C 28.1970 -20.3842
15 O2a O 26.9903 -21.0809
16 C1b C 25.7957 -20.3909
17 C1d C 24.6179 -21.0706
18 C8y C 23.4221 -20.3796
19 C8x C 23.4224 -18.9703
20 C8x C 22.2101 -18.2700
21 C8y C 20.9975 -18.9698
22 C8x C 20.9972 -20.3791
23 C8x C 22.2095 -21.0794
24 O2a O 19.7872 -18.2707
25 C1b C 18.5921 -18.9605
26 C1a C 17.4048 -18.2747
27 C1a C 23.8199 -22.2046
28 C1a C 25.5720 -22.1147
BOND 30
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 10 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 21 24 1
27 24 25 1
28 25 26 1
29 17 27 1
30 17 28 1
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