ATOM 29
1 C8y C 25.9415 -19.3841
2 C8y C 24.6713 -18.6784
3 C8y C 23.4717 -19.4547
4 C8x C 23.4717 -20.8660
5 C8x C 24.7419 -21.5011
6 C8y C 25.9415 -20.7954
7 C1d C 27.0716 -21.4313
8 X F 24.6713 -17.2671
9 C2c C 27.1411 -18.6784
10 N2b N 27.1411 -17.2671
11 N1b N 28.3407 -19.3136
12 C5a C 29.5404 -18.6079
13 O5a O 29.5404 -17.1966
14 C1b C 30.8106 -19.3136
15 C8y C 31.9397 -18.5373
16 C8x C 33.2099 -19.2430
17 C8x C 34.4095 -18.5373
18 C8x C 34.4095 -17.1260
19 C8x C 33.1393 -16.4203
20 C8x C 31.9397 -17.1260
21 O2a O 28.3407 -16.4909
22 C1b C 28.3407 -15.0796
23 C1y C 29.4698 -14.3739
24 C1x C 30.8106 -14.0211
25 C1x C 30.1049 -13.1742
26 X F 22.2490 -18.7894
27 X F 28.2449 -20.7284
28 X F 27.0954 -22.9992
29 X F 28.2824 -22.1304
BOND 31
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 6 7 1
8 2 8 1
9 1 9 1
10 9 10 2
11 9 11 1
12 11 12 1
13 12 13 2
14 12 14 1
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 15 20 1
22 10 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 23 25 1
27 24 25 1
28 3 26 1
29 7 27 1
30 7 28 1
31 7 29 1
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