ATOM 44
1 C1y C 28.6116 -18.8593
2 C1y C 27.4050 -18.1656
3 O2a O 28.6058 -20.2639
4 C1y C 29.8240 -18.1656
5 C1y C 27.4050 -16.7667
6 O7a O 26.1928 -18.8593
7 C1y C 27.3993 -20.9633
8 C1y C 29.8240 -16.7667
9 O1a O 31.0363 -18.8650
10 O2x O 28.6116 -16.0672
11 C1b C 26.1928 -16.0615
12 C7a C 24.9803 -18.1656
13 C1y C 27.3993 -22.3680
14 O2x O 26.1811 -20.2580
15 O2a O 31.0305 -16.0672
16 O1a O 26.1928 -14.6569
17 C2b C 23.7680 -18.8593
18 O6a O 24.9803 -16.7609
19 C1y C 26.1811 -23.0674
20 O1a O 28.6058 -23.0617
21 C1y C 24.9629 -20.9633
22 C1b C 32.2428 -16.7726
23 C2b C 22.5615 -18.1656
24 C1y C 24.9629 -22.3680
25 O1a O 26.1868 -24.4663
26 C1a C 23.7447 -20.2639
27 C1b C 33.4551 -16.0732
28 C8y C 21.3550 -18.8593
29 O1a O 23.7506 -23.0674
30 C8y C 34.6675 -16.7784
31 C8x C 20.1427 -18.1656
32 C8x C 21.3550 -20.2639
33 C8x C 35.8857 -16.0789
34 C8x C 34.6616 -18.1772
35 C8y C 18.9245 -18.8593
36 C8x C 20.1427 -20.9691
37 C8y C 37.0980 -16.7900
38 C8x C 35.8681 -18.8826
39 C8y C 18.9245 -20.2639
40 O1a O 17.7180 -18.1656
41 C8y C 37.0863 -18.1889
42 O1a O 38.3045 -16.0906
43 O1a O 17.7180 -20.9691
44 O1a O 38.2929 -18.8943
BOND 47
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 7 3 1 #Up
7 4 8 1
8 4 9 1 #Down
9 5 10 1
10 5 11 1 #Up
11 6 12 1
12 7 13 1
13 7 14 1
14 8 15 1 #Up
15 11 16 1
16 12 17 1
17 12 18 2
18 13 19 1
19 13 20 1 #Down
20 14 21 1
21 15 22 1
22 17 23 2
23 19 24 1
24 19 25 1 #Down
25 21 26 1 #Down
26 22 27 1
27 23 28 1
28 24 29 1 #Up
29 27 30 1
30 28 31 1
31 28 32 2
32 30 33 2
33 30 34 1
34 31 35 2
35 32 36 1
36 33 37 1
37 34 38 2
38 35 39 1
39 35 40 1
40 37 41 2
41 37 42 1
42 39 43 1
43 41 44 1
44 8 10 1
45 21 24 1
46 36 39 2
47 38 41 1
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