ATOM 30
1 C1z C 25.6556 -16.3727
2 C1z C 24.5506 -17.1753
3 C1z C 26.5685 -15.3550
4 C1y C 26.3360 -17.5592
5 C1x C 25.2368 -15.0410
6 C1z C 23.4166 -16.3669
7 O2x O 26.6559 -16.3960
8 C7x C 24.5506 -18.5652
9 C1y C 27.9469 -15.3550
10 C1y C 27.8248 -15.9133
11 C1y C 26.1383 -14.0465
12 C1y C 27.6794 -17.2741
13 O7x O 25.7718 -18.8210
14 C1y C 23.8468 -15.0410
15 C1y C 22.0208 -16.3669
16 O1a O 22.7760 -17.6986
17 O6a O 23.4746 -19.4317
18 O7x O 28.3772 -14.0406
19 C1d C 29.1508 -15.5411
20 C7x C 27.2607 -13.2381
21 O1a O 26.1324 -12.6566
22 O1a O 29.1570 -17.7339
23 O7x O 22.7187 -14.2151
24 C7x C 21.5904 -15.0410
25 C1a C 21.6543 -17.6986
26 C1a C 30.3967 -16.4943
27 C1a C 30.3254 -14.5342
28 C1a C 30.5116 -15.5516
29 O6a O 27.2607 -11.8540
30 O6a O 20.2702 -14.6163
BOND 35
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1 #Up
7 2 8 1
8 3 9 1
9 3 10 1
10 3 11 1
11 4 12 1
12 4 13 1
13 5 14 1
14 6 15 1
15 6 16 1 #Down
16 8 17 2
17 9 18 1
18 10 19 1 #Down
19 11 20 1
20 11 21 1 #Up
21 12 22 1 #Up
22 14 23 1
23 15 24 1
24 15 25 1 #Down
25 19 26 1
26 19 27 1
27 19 28 1
28 20 29 2
29 24 30 2
30 6 14 1
31 9 7 1 #Up
32 8 13 1
33 10 12 1
34 18 20 1
35 23 24 1
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