ATOM 27
1 C1y C 17.9632 -16.2226
2 C1y C 19.3556 -16.2226
3 C1y C 19.7733 -14.8998
4 O2x O 18.6594 -14.0644
5 C1x C 17.5455 -14.8998
6 C1z C 17.5455 -17.5455
7 O2x O 18.6594 -18.3809
8 C1x C 19.7733 -17.5455
9 C8y C 21.0961 -14.4821
10 C8x C 22.1405 -15.3871
11 C8y C 23.4633 -14.9694
12 C8y C 23.7418 -13.6467
13 C8x C 22.6974 -12.6719
14 C8x C 21.3746 -13.0897
15 O1a O 25.0646 -13.1593
16 O2a O 24.5077 -15.8745
17 C1a C 25.8304 -15.4568
18 C8y C 16.2226 -17.9632
19 C8x C 15.1783 -17.0581
20 C8y C 13.8555 -17.4758
21 C8y C 13.5770 -18.7987
22 C8x C 14.6213 -19.7733
23 C8x C 15.9442 -19.3556
24 O1a O 12.2542 -19.2860
25 O2a O 12.8112 -16.5707
26 C1a C 11.4884 -16.9884
27 O1a O 16.5516 -16.6447
BOND 30
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1
7 6 7 1
8 7 8 1
9 2 8 1
10 3 9 1 #Down
11 9 10 2
12 10 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 9 14 1
17 12 15 1
18 11 16 1
19 16 17 1
20 6 18 1 #Down
21 18 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 22 23 2
26 18 23 1
27 21 24 1
28 20 25 1
29 25 26 1
30 6 27 1
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