ATOM 24
1 C8y C 12.0400 -18.4100
2 C8y C 12.0400 -17.0100
3 C8y C 10.8500 -16.3100
4 C8x C 9.5900 -17.0100
5 C8y C 9.5900 -18.4100
6 C8x C 10.8500 -19.1100
7 X Cl 13.2300 -19.1100
8 C1d C 8.4000 -19.1100
9 X F 7.2100 -18.4100
10 X F 8.4000 -20.5100
11 X F 7.1400 -19.8100
12 X Cl 10.8500 -14.9100
13 N4y N 13.2300 -16.3100
14 N5x N 14.3500 -17.1500
15 C8y C 15.4700 -16.3100
16 C8y C 15.0500 -14.9800
17 C8y C 13.7200 -14.9800
18 C3b C 16.8700 -16.8000
19 N3a N 18.1300 -17.2900
20 S4a S 15.8900 -13.8600
21 C1b C 17.2900 -14.0000
22 O3c O 15.3300 -12.6000
23 C1a C 17.8500 -15.3300
24 N1a N 12.8800 -13.8600
BOND 25
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 1 7 1
8 5 8 1
9 8 9 1
10 8 10 1
11 8 11 1
12 3 12 1
13 2 13 1
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 13 17 1
19 15 18 1
20 18 19 3
21 16 20 1
22 20 21 1
23 20 22 2
24 21 23 1
25 17 24 1
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