ATOM 30
1 C8y C 14.8400 -14.2800
2 C8y C 14.8400 -15.6800
3 C8y C 16.0524 -16.3800
4 C8y C 17.2649 -15.6800
5 C8y C 17.2649 -14.2800
6 O2x O 16.0524 -13.5800
7 O2x O 17.1500 -18.6200
8 C1x C 17.1500 -20.0200
9 C1y C 18.3624 -20.7200
10 C1y C 19.5749 -20.0200
11 C1y C 19.5749 -18.6200
12 C1y C 18.3624 -17.9200
13 O1a O 20.8060 -17.9090
14 O1a O 18.3624 -22.1200
15 O1a O 20.8060 -20.7310
16 O2a O 18.3624 -16.5200
17 O5x O 16.0524 -17.7800
18 C8x C 13.6276 -13.5800
19 C8y C 12.4151 -14.2800
20 C8x C 12.4151 -15.6800
21 C8y C 13.6276 -16.3800
22 O1a O 13.6276 -17.7800
23 O1a O 11.1840 -13.5690
24 C8y C 18.4773 -13.5800
25 C8x C 19.6918 -14.2812
26 C8x C 20.9042 -13.5812
27 C8y C 20.9042 -12.1812
28 C8x C 19.6897 -11.4800
29 C8x C 18.4773 -12.1800
30 O1a O 22.1166 -11.4812
BOND 33
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 7 12 1
13 11 13 1 #Down
14 9 14 1 #Down
15 10 15 1 #Up
16 12 16 1 #Up
17 4 16 1
18 3 17 2
19 1 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 2 21 2
24 21 22 1
25 19 23 1
26 5 24 1
27 24 25 2
28 25 26 1
29 26 27 2
30 27 28 1
31 28 29 2
32 24 29 1
33 27 30 1
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