ATOM 22
1 C1y C 21.6300 -15.0500
2 C2y C 21.6300 -16.4500
3 C1y C 22.6800 -14.2100
4 C2y C 20.3000 -14.6300
5 C1x C 20.3000 -16.9400
6 C2y C 22.6800 -17.3600
7 C1y C 24.0800 -14.5600
8 O1a O 22.6800 -12.8100
9 C2x C 19.4600 -15.7500
10 C1a C 19.8100 -13.3000
11 C1x C 24.0800 -17.0800
12 C1a C 22.6800 -18.7600
13 C1x C 24.7100 -15.8200
14 C1c C 25.2700 -13.8600
15 C1b C 26.5300 -14.5600
16 C1a C 25.2700 -12.4600
17 C1b C 27.7200 -13.8600
18 C1y C 28.9100 -14.5600
19 C1z C 30.1700 -13.8600
20 O2x O 30.1700 -15.2600
21 C1a C 31.3600 -14.5600
22 C1a C 30.1700 -12.4600
BOND 24
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1 #Down
8 4 9 2
9 4 10 1
10 6 11 1
11 6 12 1
12 7 13 1
13 7 14 1
14 14 15 1
15 14 16 1 #Down
16 15 17 1
17 17 18 1
18 18 19 1
19 18 20 1
20 19 21 1
21 19 22 1
22 5 9 1
23 11 13 1
24 19 20 1
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