ATOM 36
1 C8x C 24.4424 -20.7400
2 C8y C 24.4424 -22.1416
3 C8x C 25.6562 -22.8423
4 C8x C 26.8700 -22.1416
5 C8y C 26.8700 -20.7400
6 C8x C 25.6562 -20.0392
7 O2a O 23.2286 -22.8423
8 C1d C 22.0318 -22.1512
9 X F 20.8430 -22.8374
10 X F 21.3334 -20.9429
11 X F 22.8170 -20.9622
12 N1c N 28.1025 -20.0282
13 C5a C 29.3091 -20.7247
14 O5a O 29.3095 -22.1412
15 C7a C 28.1022 -18.6377
16 O6a O 26.8765 -17.9303
17 O7a O 29.3041 -17.9434
18 C1a C 29.3385 -16.5353
19 N1y N 30.4927 -20.0410
20 N2x N 31.6882 -20.7310
21 C2y C 32.9018 -20.0301
22 C1z C 32.9017 -18.6285
23 O2x O 31.7063 -17.9384
24 C1x C 30.4925 -18.6394
25 C8y C 34.2348 -20.4631
26 C8y C 35.0586 -19.3291
27 C1x C 34.2347 -18.1953
28 C8x C 34.8050 -21.7435
29 C8x C 36.1989 -21.8899
30 C8y C 37.0227 -20.7559
31 C8x C 36.4525 -19.4755
32 X Cl 38.4483 -20.9061
33 C7a C 33.0475 -17.2416
34 O7a O 34.3421 -16.6653
35 O6a O 31.9206 -16.4229
36 C1a C 35.4685 -17.4837
BOND 39
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 2 7 1
8 7 8 1
9 8 9 1
10 8 10 1
11 8 11 1
12 5 12 1
13 12 13 1
14 13 14 2
15 12 15 1
16 15 16 2
17 15 17 1
18 17 18 1
19 13 19 1
20 19 20 1
21 20 21 2
22 21 22 1
23 23 24 1
24 19 24 1
25 22 23 1
26 21 25 1
27 25 26 1
28 26 27 1
29 22 27 1
30 25 28 2
31 28 29 1
32 29 30 2
33 30 31 1
34 26 31 2
35 30 32 1
36 22 33 1 #Down
37 33 34 1
38 33 35 2
39 34 36 1
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