ATOM 32
1 C8x C 14.3500 -16.5900
2 C8x C 14.3500 -17.9900
3 C8y C 15.5624 -18.6900
4 C8y C 16.7749 -17.9900
5 C8y C 16.7749 -16.5900
6 C8x C 15.5624 -15.8900
7 C5a C 18.0124 -18.6900
8 N1b N 19.2249 -17.9900
9 C5a C 20.4373 -18.6900
10 N1b N 21.6497 -17.9900
11 C8y C 22.8622 -18.6900
12 C8x C 22.8622 -20.0897
13 C8y C 24.0746 -20.7897
14 C8y C 25.2871 -20.0897
15 C8x C 25.2870 -18.6900
16 C8x C 24.0746 -17.9900
17 X F 15.5624 -20.0898
18 X F 18.0060 -15.8790
19 O5a O 18.0186 -20.0897
20 O5a O 20.4373 -20.0900
21 X Cl 24.0746 -22.1900
22 O2a O 26.4868 -20.7825
23 C1d C 27.6758 -20.0959
24 C1c C 28.8883 -19.3959
25 X F 26.9758 -18.8835
26 X F 28.3758 -21.3083
27 O2a O 30.1143 -20.1040
28 X F 28.8883 -17.9902
29 C1d C 31.3220 -19.4068
30 X F 32.5031 -20.0889
31 X F 31.3225 -17.9904
32 X F 32.5344 -18.7068
BOND 33
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 11 16 1
18 3 17 1
19 5 18 1
20 7 19 2
21 9 20 2
22 13 21 1
23 14 22 1
24 22 23 1
25 23 24 1
26 23 25 1
27 23 26 1
28 24 27 1
29 24 28 1
30 27 29 1
31 29 30 1
32 29 31 1
33 29 32 1
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