ATOM 26
1 C8y C 13.3000 -18.2000
2 C8y C 13.3000 -19.6000
3 N5x N 14.5124 -20.3000
4 C8x C 15.7249 -19.6000
5 C8y C 15.7249 -18.2000
6 N5x N 14.5124 -17.5000
7 C8x C 12.0876 -17.5000
8 C8x C 10.8751 -18.2000
9 C8y C 10.8751 -19.6000
10 C8x C 12.0876 -20.3000
11 X Cl 9.6440 -20.3110
12 O2a O 16.9560 -17.4890
13 C8y C 18.1612 -18.1847
14 C8x C 18.1616 -19.5996
15 C8x C 19.3742 -20.2993
16 C8y C 20.5865 -19.5989
17 C8x C 20.5860 -18.1839
18 C8x C 19.3734 -17.4843
19 O2a O 21.7924 -20.3000
20 C1c C 23.0049 -19.6000
21 C7a C 24.2173 -20.3000
22 O7a O 25.4297 -19.6000
23 C1b C 26.6273 -20.2915
24 C1a C 23.0049 -18.2002
25 O6a O 24.2173 -21.7000
26 C1a C 27.8156 -19.6055
BOND 28
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 1 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 2 10 1
12 9 11 1
13 5 12 1
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 13 18 1
21 16 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 20 24 1
27 21 25 2
28 23 26 1
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