ATOM 22
1 C1y C 12.0456 -12.5568
2 C1y C 10.8174 -11.8465
3 C1y C 13.2567 -11.8465
4 C1y C 10.8174 -10.4551
5 O1a O 9.6180 -12.5568
6 C1y C 13.2567 -10.4551
7 O1a O 14.4676 -12.5568
8 O2x O 12.0456 -9.7622
9 C1a C 9.6122 -9.7565
10 O1a O 14.4676 -9.7622
11 C1y C 8.4000 -15.0500
12 C1y C 8.4000 -16.4500
13 C1y C 9.6124 -17.1500
14 C1y C 10.8249 -16.4500
15 C1y C 10.8249 -15.0500
16 O2x O 9.6124 -14.3500
17 O2a O 12.0560 -14.1290
18 O1a O 12.0560 -17.1610
19 O1a O 7.1876 -17.1500
20 O1a O 9.6124 -18.5498
21 C1b C 7.1876 -14.3500
22 O1a O 5.9921 -15.0404
BOND 23
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Up
5 3 6 1
6 3 7 1 #Down
7 4 8 1
8 4 9 1 #Down
9 6 10 1 #Either
10 6 8 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 11 16 1
17 15 17 1 #Down
18 14 18 1 #Down
19 12 19 1 #Down
20 13 20 1 #Up
21 11 21 1 #Up
22 21 22 1
23 1 17 1 #Down
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