ATOM 35
1 C1z C 25.4449 -17.1041
2 C1z C 26.6594 -16.4092
3 C1y C 24.2362 -16.3918
4 C1x C 25.4449 -18.5054
5 C1a C 25.9932 -15.6969
6 C2y C 26.6768 -15.0139
7 C1x C 27.8621 -17.1215
8 C1a C 26.6477 -17.8048
9 C1z C 23.0160 -17.0924
10 C1x C 24.2479 -14.9905
11 C1x C 24.2246 -19.2001
12 C1y C 27.8971 -14.3307
13 C2x C 25.4682 -14.3073
14 C1x C 29.1466 -16.4385
15 C1y C 23.0102 -18.4995
16 C1x C 21.8075 -16.3859
17 C1a C 23.0043 -15.6911
18 C1z C 29.0940 -15.0430
19 C1y C 27.9147 -12.9353
20 C1z C 21.8075 -19.1944
21 C1y C 20.5930 -17.0924
22 C1x C 30.3026 -14.3657
23 C6a C 30.2909 -15.7436
24 C1y C 29.1291 -12.2521
25 C1a C 26.9046 -11.9368
26 C1y C 20.5930 -18.4995
27 C1b C 22.4963 -20.6887
28 C1a C 21.0952 -20.6887
29 O1a O 19.3727 -16.3859
30 C1x C 30.3260 -12.9703
31 O6a O 31.5053 -15.0313
32 O6a O 30.2852 -17.1508
33 C1a C 29.1232 -10.8510
34 O1a O 19.3727 -19.1884
35 O1a O 23.8919 -20.6887
BOND 39
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 2 8 1 #Down
8 3 9 1
9 3 10 1
10 4 11 1
11 6 12 1
12 6 13 2
13 7 14 1
14 9 15 1
15 9 16 1
16 9 17 1 #Up
17 12 18 1
18 12 19 1
19 15 20 1
20 16 21 1
21 18 22 1
22 18 23 1 #Up
23 19 24 1
24 19 25 1 #Up
25 20 26 1
26 20 27 1 #Down
27 20 28 1 #Up
28 21 29 1 #Down
29 22 30 1
30 23 31 1
31 23 32 2
32 24 33 1 #Down
33 26 34 1 #Up
34 27 35 1
35 10 13 1
36 11 15 1
37 14 18 1
38 21 26 1
39 24 30 1
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