ATOM 22
1 P1a P 13.3000 -13.3000
2 N1b N 14.7000 -13.3000
3 O2b O 11.9000 -13.3000
4 S0 S 13.3000 -11.9000
5 O2b O 13.3000 -14.7000
6 C8y C 11.2000 -12.0876
7 C8y C 12.0876 -15.4000
8 C8x C 10.8921 -14.7096
9 C8x C 9.6796 -15.4095
10 C8y C 9.6794 -16.8095
11 C8x C 10.8749 -17.4999
12 C8x C 12.0874 -16.8000
13 C8x C 11.8904 -10.8921
14 C8x C 11.1905 -9.6796
15 C8y C 9.7905 -9.6794
16 C8x C 9.1001 -10.8749
17 C8x C 9.8000 -12.0874
18 X Cl 8.4566 -17.5154
19 X Cl 9.0846 -8.4566
20 C2c C 15.9124 -14.0000
21 C1a C 17.1249 -13.3000
22 N2a N 15.9124 -15.3998
BOND 23
1 1 2 1
2 1 3 1
3 1 4 2
4 1 5 1
5 3 6 1
6 5 7 1
7 7 8 2
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 2
12 7 12 1
13 6 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 6 17 1
19 10 18 1
20 15 19 1
21 2 20 1
22 20 21 1
23 20 22 2
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