ATOM 27
1 C8y C 10.9200 -19.6700
2 C8x C 10.9200 -21.0700
3 C8y C 12.1324 -21.7700
4 C8x C 13.3449 -21.0700
5 C8y C 13.3449 -19.6700
6 C8x C 12.1324 -18.9700
7 C1a C 9.7076 -18.9700
8 C1a C 12.1324 -23.1698
9 C5a C 14.5824 -18.9700
10 N1c N 15.7949 -19.6700
11 N1b N 17.0073 -18.9700
12 C5a C 18.2197 -19.6700
13 C8y C 19.4322 -18.9700
14 O5a O 14.5886 -17.5703
15 C1d C 15.7949 -21.2098
16 C1a C 17.0261 -21.9208
17 C1a C 14.6013 -21.8990
18 C1a C 15.7949 -22.6098
19 O5a O 18.2197 -20.9299
20 C8y C 20.6653 -19.6822
21 C8y C 21.8779 -18.9824
22 C8x C 21.8781 -17.5824
23 C8x C 20.6450 -16.8702
24 C8x C 19.4324 -17.5700
25 C1a C 20.6649 -21.0699
26 O2a O 23.1085 -19.6937
27 C1a C 24.3250 -18.9922
BOND 28
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 3 8 1
9 5 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 9 14 2
15 10 15 1
16 15 16 1
17 15 17 1
18 15 18 1
19 12 19 2
20 13 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 13 24 1
26 20 25 1
27 21 26 1
28 26 27 1
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