ATOM 24
1 C2y C 16.2400 -17.7100
2 C8y C 15.4700 -16.5200
3 C8y C 15.8900 -15.1200
4 N1y N 17.1500 -14.7000
5 N2x N 17.7100 -17.7100
6 C5x C 18.4100 -15.4000
7 C1y C 18.6200 -16.8000
8 C8x C 14.9800 -14.1400
9 C8x C 13.6500 -14.4900
10 C8y C 13.2300 -15.7500
11 C8x C 14.1400 -16.8000
12 O5x O 19.5300 -14.5600
13 X Cl 11.7600 -16.1000
14 C1b C 17.1500 -13.3000
15 C1b C 18.5500 -12.7400
16 O1a O 18.5500 -11.2700
17 C8y C 15.5400 -18.9000
18 C8x C 14.2124 -18.8658
19 C8x C 13.5447 -20.2143
20 C8x C 14.2765 -21.4550
21 C8x C 15.6779 -21.4172
22 C8y C 16.3418 -20.0688
23 X F 17.6732 -20.1029
24 O1a O 19.8800 -17.2200
BOND 26
1 3 4 1
2 1 5 2
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 3 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 2 11 2
13 6 12 2
14 10 13 1
15 4 14 1
16 14 15 1
17 15 16 1
18 1 17 1
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 17 22 2
25 22 23 1
26 7 24 1
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