ATOM 26
1 C8x C 10.3600 -17.2900
2 C8y C 10.3600 -18.6900
3 C8x C 11.5724 -19.3900
4 C8y C 12.7849 -18.6900
5 C8y C 12.7849 -17.2900
6 C8y C 11.5724 -16.5900
7 N1b N 14.0224 -16.5900
8 C5a C 15.2349 -17.2900
9 C8y C 16.4473 -16.5900
10 O2a O 9.1476 -19.3900
11 X Br 11.5724 -15.1902
12 X Br 14.0160 -19.4010
13 C1d C 7.9521 -18.6996
14 X F 6.7647 -19.3851
15 X F 7.9520 -17.2903
16 X F 6.7396 -17.9996
17 C8y C 17.7285 -17.1604
18 N5x N 18.6669 -16.1182
19 C8y C 17.9657 -14.9036
20 S2x S 16.5939 -15.1952
21 C1a C 18.5366 -13.6211
22 C1d C 18.0165 -18.5160
23 X F 19.3333 -18.9445
24 X F 16.9442 -19.4807
25 X F 18.3088 -19.8683
26 O5a O 15.2349 -18.6898
BOND 27
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 5 7 1
8 7 8 1
9 8 9 1
10 2 10 1
11 6 11 1
12 4 12 1
13 10 13 1
14 13 14 1
15 13 15 1
16 13 16 1
17 9 17 2
18 17 18 1
19 18 19 2
20 19 20 1
21 9 20 1
22 19 21 1
23 17 22 1
24 22 23 1
25 22 24 1
26 22 25 1
27 8 26 2
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