ATOM 23
1 C1x C 19.8100 -19.4600
2 O2x O 19.8100 -20.8600
3 C1x C 21.0224 -21.5600
4 C1x C 22.2349 -20.8600
5 C1y C 22.2349 -19.4600
6 C1x C 21.0224 -18.7600
7 C1y C 23.4660 -18.7490
8 C1x C 24.6712 -19.4447
9 C2y C 25.8835 -18.7446
10 C2y C 25.8835 -17.3446
11 C5x C 24.6783 -16.6489
12 C1x C 23.4659 -17.3490
13 C2c C 27.1124 -16.6600
14 C1b C 28.3249 -17.3600
15 C1a C 29.5373 -16.6600
16 O5x O 24.6785 -15.2604
17 O1a O 27.1151 -19.4554
18 N2b N 27.1232 -15.2604
19 O2a O 28.3024 -14.5600
20 C1b C 29.5149 -15.2600
21 C2b C 30.7273 -14.5600
22 C2b C 31.9397 -15.2600
23 X Cl 33.1522 -14.5600
BOND 24
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 1
13 7 12 1
14 10 13 1
15 13 14 1
16 14 15 1
17 11 16 2
18 9 17 1
19 13 18 2
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 2
24 22 23 1
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