ATOM 22
1 C8y C 29.5068 -18.3329
2 C8x C 29.5652 -19.7331
3 C8x C 30.7046 -20.4406
4 C8y C 31.9255 -19.7478
5 C8x C 31.9309 -18.3444
6 C8x C 30.7215 -17.6369
7 C8x C 25.8543 -20.4154
8 C8y C 27.0762 -19.7241
9 C8y C 27.0821 -18.3178
10 C8x C 25.8756 -17.6122
11 C8x C 24.6596 -18.3069
12 C8x C 24.6442 -19.7037
13 C1d C 28.2998 -17.6312
14 C8y C 28.2890 -16.2313
15 O1a O 28.2817 -19.0324
16 C8x C 29.4945 -15.5243
17 N5x N 29.4837 -14.1245
18 C8x C 28.2658 -13.4339
19 N5x N 27.0589 -14.1432
20 C8x C 27.0698 -15.5431
21 X Cl 28.2790 -20.4292
22 X Cl 33.1290 -20.4519
BOND 24
1 10 11 2
2 11 12 1
3 12 7 2
4 4 5 2
5 9 13 1
6 13 14 1
7 5 6 1
8 13 1 1
9 6 1 2
10 13 15 1
11 1 2 1
12 2 3 2
13 3 4 1
14 7 8 1
15 14 16 2
16 16 17 1
17 17 18 2
18 18 19 1
19 19 20 2
20 20 14 1
21 8 9 2
22 8 21 1
23 9 10 1
24 4 22 1
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