ATOM 39
1 C8y C 19.9767 -18.6741
2 C8y C 18.7771 -17.9779
3 C8y C 21.1822 -17.9953
4 C8y C 19.9709 -20.0668
5 C8y C 18.7830 -16.5852
6 C8x C 17.5775 -18.6741
7 C8y C 21.1939 -16.5969
8 C7x C 22.5104 -18.4343
9 C8x C 21.1705 -20.7690
10 C8x C 18.7654 -20.7515
11 C8y C 19.9884 -15.8889
12 C8x C 17.5775 -15.8830
13 C8y C 16.3722 -17.9779
14 C1x C 22.5280 -16.1698
15 O7x O 23.3471 -17.3049
16 O6a O 22.9317 -19.7625
17 C8y C 21.1645 -22.1617
18 C8x C 18.7537 -22.1442
19 O2a O 20.0350 -14.4083
20 C8y C 16.3722 -16.5852
21 O2a O 15.1667 -18.6741
22 C8y C 19.9475 -22.8464
23 O2x O 22.1944 -23.1038
24 C1y C 20.0233 -12.8227
25 O2a O 15.1667 -15.8830
26 C1a C 13.9554 -17.9779
27 O2x O 20.2283 -24.2157
28 C1x C 21.6210 -24.3794
29 C1y C 18.8237 -12.1263
30 O2x O 21.2345 -12.1439
31 C1a C 13.9554 -16.5852
32 C1y C 18.8296 -10.7336
33 O1a O 17.6124 -12.8110
34 C1x C 21.2405 -10.7453
35 C1y C 20.0409 -10.0431
36 O2a O 17.6241 -10.0314
37 O2a O 20.0467 -8.6627
38 C1a C 16.4188 -10.7278
39 C1a C 21.2579 -7.9674
BOND 44
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 7 14 1
14 8 15 1
15 8 16 2
16 9 17 1
17 10 18 2
18 11 19 1
19 12 20 2
20 13 21 1
21 17 22 2
22 17 23 1
23 24 19 1 #Either
24 20 25 1
25 21 26 1
26 22 27 1
27 23 28 1
28 24 29 1
29 24 30 1
30 25 31 1
31 29 32 1
32 29 33 1 #Down
33 30 34 1
34 32 35 1
35 32 36 1 #Up
36 35 37 1 #Down
37 36 38 1
38 37 39 1
39 7 11 2
40 13 20 1
41 14 15 1
42 18 22 1
43 27 28 1
44 34 35 1
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