ATOM 38
1 C1z C 25.4575 -30.1782
2 C1z C 25.4750 -28.8097
3 C1y C 24.2703 -30.8566
4 C1x C 27.8319 -30.1374
5 C1a C 25.4458 -31.5525
6 C1y C 26.6739 -28.1371
7 C1x C 24.2937 -28.1079
8 C1a C 25.4692 -27.4295
9 C1z C 23.0831 -30.1665
10 C1x C 24.2703 -32.2309
11 C1y C 27.8496 -28.8389
12 C1d C 26.6856 -26.7628
13 C5x C 23.0948 -28.7921
14 C1y C 21.8901 -30.8449
15 C1a C 23.7714 -31.5351
16 C2x C 23.0714 -32.9210
17 O1a O 29.1771 -28.4705
18 C5a C 27.8728 -26.0844
19 C1a C 25.4809 -26.0727
20 O1a O 26.6739 -25.1025
21 O5x O 21.9075 -28.0902
22 C2y C 21.8841 -32.2252
23 C1x C 20.7029 -30.1606
24 C1b C 29.0660 -26.7685
25 O5a O 27.8728 -24.7041
26 C1z C 20.7029 -32.9153
27 C1y C 19.5039 -30.8449
28 C1c C 30.2532 -26.0901
29 C5x C 19.5039 -32.2252
30 C1a C 21.3753 -34.1025
31 C1a C 19.9951 -34.1025
32 O1a O 18.3108 -30.1606
33 C1d C 31.4404 -26.7745
34 O1a O 30.2532 -24.7099
35 O5x O 18.3108 -32.9153
36 C1a C 32.6334 -27.4646
37 C1a C 32.6334 -26.0844
38 O1a O 31.4345 -28.1547
BOND 41
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 3 10 1
10 4 11 1
11 6 12 1
12 7 13 1
13 9 14 1
14 9 15 1 #Up
15 10 16 1
16 11 17 1 #Down
17 12 18 1
18 12 19 1 #Down
19 12 20 1 #Up
20 13 21 2
21 14 22 1
22 14 23 1
23 18 24 1
24 18 25 2
25 22 26 1
26 23 27 1
27 24 28 1
28 26 29 1
29 26 30 1
30 26 31 1
31 27 32 1 #Up
32 28 33 1
33 28 34 1
34 29 35 2
35 33 36 1
36 33 37 1
37 33 38 1
38 6 11 1
39 9 13 1
40 16 22 2
41 27 29 1
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