ATOM 33
1 C8y C 25.8170 -29.0586
2 C1y C 24.6090 -29.7532
3 C8y C 25.8170 -27.6578
4 C8y C 27.0368 -29.7647
5 O2x O 23.4008 -29.0586
6 C1y C 24.6090 -31.1481
7 C8x C 27.0368 -26.9574
8 O2a O 24.6030 -26.9574
9 C8y C 28.3150 -29.0586
10 O1a O 27.0368 -31.1655
11 C1y C 22.1926 -29.7532
12 C1y C 23.4008 -31.8485
13 O1a O 25.8170 -31.8485
14 C8y C 28.2509 -27.6578
15 C8y C 29.4531 -29.7706
16 C1y C 22.1926 -31.1481
17 C1b C 20.9845 -29.0586
18 O1a O 23.4065 -33.2433
19 O2x O 29.4648 -26.9633
20 C8x C 30.6672 -29.0703
21 O5x O 29.4474 -31.1714
22 O1a O 20.9845 -31.8485
23 O1a O 19.7704 -29.7532
24 C8y C 30.6730 -27.6637
25 C8y C 31.8928 -26.9750
26 C8x C 31.8928 -25.5742
27 C8x C 33.1010 -27.6811
28 C8y C 33.1127 -24.8738
29 C8x C 34.3208 -26.9867
30 C8y C 34.3266 -25.5859
31 O1a O 33.1184 -23.4673
32 O1a O 35.5464 -24.8855
33 C1a C 23.3939 -27.6559
BOND 36
1 2 1 1 #Up
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 6 12 1
12 6 13 1 #Down
13 7 14 1
14 9 15 1
15 11 16 1
16 11 17 1 #Up
17 12 18 1 #Up
18 14 19 1
19 15 20 1
20 15 21 2
21 16 22 1 #Down
22 17 23 1
23 19 24 1
24 24 25 1
25 25 26 1
26 25 27 2
27 26 28 2
28 27 29 1
29 28 30 1
30 28 31 1
31 30 32 1
32 9 14 2
33 12 16 1
34 20 24 2
35 29 30 2
36 8 33 1
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