ATOM 19
1 C1z C 28.7700 -18.8300
2 C1y C 27.6500 -19.4600
3 C1z C 30.1700 -16.7300
4 C2y C 29.8900 -19.4600
5 X Cl 28.7700 -20.0200
6 C1y C 27.6500 -18.2000
7 C1y C 26.5300 -18.8300
8 C1z C 28.7700 -17.5000
9 X Cl 31.5000 -16.2400
10 X Cl 30.1700 -15.1900
11 C2y C 29.8900 -18.2000
12 X Cl 30.5200 -20.5800
13 C1y C 26.5300 -17.5000
14 C1x C 25.2700 -16.8700
15 C1y C 25.4100 -19.4600
16 X Cl 28.8400 -16.3100
17 X Cl 31.0100 -17.5000
18 C1y C 25.4100 -18.2000
19 O2x O 24.0800 -18.5500
BOND 23
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 3 10 1
10 4 11 2
11 4 12 1
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 1 #Down
16 11 17 1
17 13 18 1
18 6 8 1
19 8 11 1
20 13 14 1
21 15 18 1
22 18 19 1 #Down
23 15 19 1 #Down
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