ATOM 22
1 C8x C 12.9500 -13.2300
2 C8y C 12.9500 -14.6300
3 C8y C 14.1624 -15.3300
4 C8y C 15.3749 -14.6300
5 C8y C 15.3749 -13.2300
6 C8x C 14.1624 -12.5300
7 C1x C 16.5873 -15.3300
8 C1y C 17.7997 -14.6300
9 C1z C 17.7997 -13.2300
10 O2x O 16.5873 -12.5300
11 C1x C 19.0122 -15.3300
12 N1y N 20.2246 -14.6300
13 C1x C 20.2246 -13.2300
14 C1y C 19.0122 -12.5300
15 C8x C 11.7376 -15.3300
16 C8x C 11.7376 -16.7300
17 C8x C 12.9500 -17.4300
18 C8x C 14.1624 -16.7300
19 C1a C 19.0122 -11.1303
20 C1a C 21.4411 -15.3323
21 O1a O 17.7997 -11.6200
22 X Cl 25.9700 -13.8600
BOND 24
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 9 14 1
17 2 15 1
18 15 16 2
19 16 17 1
20 17 18 2
21 3 18 1
22 14 19 1
23 12 20 1
24 9 21 1
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