ATOM 29
1 C2b C 26.5299 -18.8182
2 C5a C 25.3154 -19.5246
3 C8y C 24.0952 -18.8182
4 O5a O 25.3154 -20.9257
5 C8y C 22.8925 -19.5246
6 C8x C 24.1011 -17.4169
7 C8x C 21.6782 -18.8182
8 C8x C 22.8925 -16.7162
9 C8y C 21.6723 -17.4169
10 O1a O 20.4579 -16.7162
11 O1a O 22.8925 -20.9280
12 C2b C 27.7398 -19.5116
13 C8y C 28.9377 -18.8147
14 C8x C 30.1326 -19.4993
15 C8y C 31.3457 -18.7937
16 C8y C 31.3411 -17.3903
17 C8y C 30.1462 -16.7056
18 C8x C 28.9331 -17.4113
19 O1a O 32.5673 -16.6768
20 C1b C 30.1416 -15.2999
21 C2b C 31.3792 -14.5797
22 C1b C 32.5857 -19.5042
23 C2b C 33.7773 -18.8110
24 C2c C 34.9754 -19.4975
25 C1a C 36.1610 -18.8077
26 C1a C 34.9803 -20.9126
27 C2c C 31.3743 -13.1944
28 C1a C 30.1512 -12.4939
29 C1a C 32.5820 -12.4915
BOND 30
1 1 2 1
2 2 3 1
3 2 4 2
4 3 5 1
5 3 6 2
6 5 7 2
7 6 8 1
8 7 9 1
9 9 10 1
10 8 9 2
11 5 11 1
12 1 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 13 18 1
20 16 19 1
21 17 20 1
22 20 21 1
23 15 22 1
24 22 23 1
25 23 24 2
26 24 25 1
27 24 26 1
28 21 27 2
29 27 28 1
30 27 29 1
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