ATOM 20
1 C8x C 29.4299 -20.0457
2 C8x C 29.4299 -21.4475
3 C8x C 28.2384 -22.1485
4 C8x C 26.9767 -21.4475
5 C8y C 26.9767 -20.0457
6 N5x N 28.2384 -19.3448
7 C8x C 24.5936 -21.4475
8 C8y C 24.5936 -20.0457
9 C1c C 25.7852 -19.3448
10 C8x C 23.3320 -22.1485
11 C8y C 22.1404 -21.4475
12 C8x C 22.1404 -20.0457
13 C8x C 23.3320 -19.3448
14 X Cl 20.9489 -22.1485
15 O2a O 25.7852 -17.9430
16 C1b C 26.9992 -17.2421
17 C1b C 28.1962 -17.9334
18 N1c N 29.3852 -17.2470
19 C1a C 30.5779 -17.9359
20 C1a C 29.3854 -15.8404
BOND 21
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 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 11 14 1
16 9 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 18 20 1
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