ATOM 30
1 C8y C 18.2245 -14.2924
2 C1x C 19.6338 -14.2924
3 C1y C 20.6203 -15.2790
4 C1z C 20.6203 -16.6883
5 C1x C 19.6338 -17.6748
6 C8y C 18.2245 -17.6748
7 C8y C 17.2379 -16.6883
8 C8y C 17.2379 -15.2790
9 C8x C 17.8722 -12.9535
10 C8y C 16.4628 -12.6012
11 C8y C 15.4762 -13.5877
12 C8y C 15.8286 -14.9267
13 C8y C 15.8286 -17.0407
14 C8y C 15.4762 -18.4500
15 C8y C 16.4628 -19.4365
16 C8x C 17.8017 -19.0842
17 O2a O 14.6306 -16.6178
18 C1a C 13.4327 -17.3225
19 C1a C 21.8888 -14.7152
20 O2a O 14.1126 -13.2192
21 O2a O 16.0869 -11.2438
22 C1a C 13.4128 -12.0071
23 C1a C 14.8748 -10.5439
24 O2a O 14.1137 -18.8271
25 O2a O 16.0908 -20.8131
26 C1a C 14.7385 -21.1755
27 C1a C 21.8327 -17.3883
28 O1a O 21.9726 -16.3260
29 C1a C 13.7514 -20.1794
30 O1a O 14.6162 -15.6267
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 1 1 #Up
9 1 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 8 12 2
14 7 13 2
15 13 14 1
16 14 15 2
17 15 16 1
18 6 16 2
19 17 13 1
20 17 18 1
21 3 19 1 #Down
22 11 20 1
23 10 21 1
24 20 22 1
25 21 23 1
26 14 24 1
27 15 25 1
28 25 26 1
29 4 27 1 #Down
30 4 28 1 #Up
31 24 29 1
32 12 30 1
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