ATOM 31
1 N1y N 10.8708 -6.2929
2 C5a C 10.6051 -5.5078
3 N1b N 9.7961 -5.3506
4 O5a O 11.1518 -4.8875
5 C1x C 10.3926 -6.9694
6 C1x C 10.8868 -7.6352
7 C8y C 11.6618 -6.5435
8 C8y C 11.6712 -7.3672
9 C8x C 12.3887 -7.7699
10 C8x C 12.3700 -6.1225
11 C8y C 13.0906 -6.5280
12 C8y C 13.1016 -7.3536
13 C8y C 9.0849 -5.7687
14 C8x C 8.3698 -5.3622
15 C8y C 7.6586 -5.7803
16 C8x C 7.6650 -6.6053
17 C8y C 8.3827 -7.0122
18 C8x C 9.0939 -6.5941
19 C1d C 13.8000 -6.1068
20 X F 14.5083 -5.6875
21 X F 14.2042 -6.8167
22 X F 13.3792 -5.3875
23 O2a O 13.8198 -7.7595
24 C1a C 13.8274 -8.5845
25 C8y C 8.3892 -7.8371
26 C8x C 7.6806 -8.2515
27 C8x C 7.6871 -9.0765
28 C8x C 8.4048 -9.4834
29 N5x N 9.1160 -9.0653
30 C8x C 9.1095 -8.2403
31 X F 6.9409 -5.3734
BOND 34
1 6 8 1
2 7 1 1
3 13 14 2
4 14 15 1
5 15 16 2
6 16 17 1
7 17 18 2
8 18 13 1
9 2 3 1
10 11 19 1
11 2 4 2
12 19 20 1
13 7 8 2
14 19 21 1
15 8 9 1
16 19 22 1
17 9 12 2
18 12 23 1
19 11 10 2
20 23 24 1
21 10 7 1
22 17 25 1
23 11 12 1
24 3 13 1
25 1 2 1
26 1 5 1
27 25 26 2
28 26 27 1
29 27 28 2
30 28 29 1
31 29 30 2
32 30 25 1
33 5 6 1
34 15 31 1
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