ATOM 22
1 C8x C 13.6500 -17.4300
2 C8x C 13.6500 -18.8300
3 C8y C 14.8624 -19.5300
4 C8y C 16.0749 -18.8300
5 C8y C 16.0749 -17.4300
6 C8x C 14.8624 -16.7300
7 C1a C 14.8624 -20.9298
8 N1b N 17.3060 -19.5410
9 X Cl 17.3060 -16.7190
10 C5a C 18.5111 -18.8453
11 C1b C 19.6935 -19.5281
12 O5a O 18.5116 -17.4304
13 C1b C 20.8875 -18.8388
14 N1y N 22.0754 -19.5248
15 C1x C 22.0754 -20.9298
16 C1x C 23.2878 -21.6298
17 C1x C 24.5003 -20.9298
18 C1y C 24.5003 -19.5248
19 C1y C 23.2879 -18.8248
20 C1x C 25.5407 -18.5880
21 C1x C 24.9713 -17.3091
22 C1x C 23.5790 -17.4554
BOND 24
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 3 7 1
8 4 8 1
9 5 9 1
10 8 10 1
11 10 11 1
12 10 12 2
13 11 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 14 19 1
21 18 20 1
22 20 21 1
23 21 22 1
24 19 22 1
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