ATOM 41
1 C1y C 25.8319 -24.4983
2 C1y C 25.8319 -25.8931
3 C1y C 27.0427 -26.5905
4 O2x O 28.2465 -25.8931
5 C1y C 28.2465 -24.4983
6 C1y C 27.0427 -23.8009
7 C8y C 27.0444 -27.9853
8 O1a O 24.6243 -26.5910
9 O1a O 24.6243 -23.8003
10 O1a O 27.0444 -22.4062
11 C1a C 29.4549 -23.8018
12 C8y C 28.2524 -28.6849
13 C8y C 28.2466 -30.0852
14 O2x O 29.4663 -27.9912
15 C8y C 25.8250 -28.6849
16 C8y C 27.0444 -30.7919
17 C8y C 29.4546 -30.7976
18 C8y C 30.6730 -28.6965
19 C8y C 25.8191 -30.0852
20 O1a O 24.6052 -27.9853
21 O1a O 27.0444 -32.1922
22 C8x C 30.6673 -30.0969
23 O5x O 29.4489 -32.1922
24 C8y C 31.8927 -28.0028
25 C1y C 24.5994 -30.7919
26 C8x C 33.1006 -28.7082
27 C8x C 31.8927 -26.6023
28 O2x O 23.3913 -30.0852
29 C1y C 24.5994 -32.1922
30 C8x C 34.3204 -28.0145
31 C8x C 33.1123 -25.9016
32 C1y C 22.1719 -30.7919
33 C1y C 23.3913 -32.8859
34 O1a O 25.8191 -32.8859
35 C8y C 34.3262 -26.6140
36 C1y C 22.1719 -32.1922
37 C1b C 20.9580 -30.0852
38 O1a O 23.3913 -34.2920
39 O1a O 35.5399 -25.9132
40 O1a O 20.9580 -32.8859
41 O1a O 19.7512 -30.7919
BOND 45
1 2 3 1
2 1 9 1 #Down
3 3 4 1
4 6 10 1 #Up
5 4 5 1
6 5 11 1 #Down
7 5 6 1
8 6 1 1
9 3 7 1 #Up
10 1 2 1
11 2 8 1 #Down
12 12 7 1
13 12 13 2
14 12 14 1
15 7 15 2
16 13 16 1
17 13 17 1
18 14 18 1
19 15 19 1
20 15 20 1
21 16 21 1
22 17 22 1
23 17 23 2
24 18 24 1
25 25 19 1 #Up
26 24 26 2
27 24 27 1
28 25 28 1
29 25 29 1
30 26 30 1
31 27 31 2
32 28 32 1
33 29 33 1
34 29 34 1 #Down
35 30 35 2
36 32 36 1
37 32 37 1 #Up
38 33 38 1 #Up
39 35 39 1
40 36 40 1 #Down
41 37 41 1
42 16 19 2
43 18 22 2
44 31 35 1
45 33 36 1
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