ATOM 24
1 C1x C 22.2693 -19.4471
2 C1x C 22.2693 -20.8470
3 C1x C 23.4846 -21.5470
4 C1x C 23.4846 -18.7471
5 C2y C 24.6928 -19.4471
6 C2y C 24.6868 -20.8504
7 C5x C 26.0198 -21.2897
8 N1y N 26.8492 -20.1577
9 C5x C 26.0291 -19.0189
10 C8y C 28.2491 -20.1635
11 C8y C 28.9376 -21.3795
12 C8x C 30.3375 -21.3153
13 C8y C 31.0426 -20.1759
14 C8y C 30.3475 -18.9606
15 C8x C 28.9476 -18.9548
16 O2a O 31.0526 -17.7510
17 C1c C 32.4525 -17.7570
18 O5x O 26.4674 -17.6894
19 O5x O 26.4469 -22.6230
20 X Cl 32.4424 -20.1817
21 X F 28.2300 -22.5875
22 C1a C 33.1574 -16.5474
23 C3b C 33.1474 -18.9723
24 C3a C 33.8423 -20.1874
BOND 26
1 2 3 1
2 3 6 1
3 5 4 1
4 10 11 2
5 11 12 1
6 12 13 2
7 13 14 1
8 14 15 2
9 15 10 1
10 5 6 2
11 14 16 1
12 6 7 1
13 16 17 1
14 7 8 1
15 9 18 2
16 8 9 1
17 7 19 2
18 9 5 1
19 13 20 1
20 4 1 1
21 11 21 1
22 8 10 1
23 17 22 1
24 17 23 1
25 1 2 1
26 23 24 3
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