ATOM 30
1 C1x C 25.8926 -23.2933
2 C1y C 25.8926 -24.6660
3 C1x C 27.0813 -25.3524
4 C1y C 28.2703 -24.6660
5 C1z C 28.2703 -23.2933
6 C1x C 27.0813 -22.6068
7 C1x C 29.4590 -25.3524
8 C1x C 30.6475 -24.6660
9 C1y C 30.6475 -23.2933
10 C1y C 29.4590 -22.6068
11 C1y C 31.8364 -22.6068
12 C1z C 31.8364 -21.2343
13 C1x C 30.6475 -20.5480
14 C1x C 29.4590 -21.2343
15 C1x C 34.2141 -22.6068
16 C1x C 34.2141 -21.2343
17 C1y C 33.0252 -20.5480
18 C1c C 33.0252 -19.1753
19 C1c C 34.2180 -18.4867
20 C1b C 35.3920 -19.1648
21 C1c C 36.5551 -18.4931
22 C1c C 37.7237 -19.1682
23 C1a C 37.7237 -20.5477
24 C1a C 28.2703 -21.9205
25 C1a C 31.8364 -19.8620
26 C1a C 31.8364 -18.4889
27 C1a C 38.9123 -18.4817
28 O1a O 34.2181 -17.0841
29 O1a O 24.6969 -25.3560
30 C1a C 36.5551 -17.0931
BOND 33
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 15 16 1
18 16 17 1
19 12 17 1
20 11 15 1
21 17 18 1
22 18 19 1
23 19 20 1
24 20 21 1
25 21 22 1
26 22 23 1
27 5 24 1 #Up
28 12 25 1 #Up
29 18 26 1 #Down
30 22 27 1
31 19 28 1 #Up
32 2 29 1 #Up
33 21 30 1 #Up
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