ATOM 22
1 C1y C 26.3721 -16.7870
2 C1b C 25.1736 -16.0913
3 C1y C 26.3721 -18.1668
4 O2x O 27.5824 -16.0913
5 O2a O 23.9808 -16.7753
6 C1y C 27.5824 -18.8626
7 O1a O 25.1736 -18.7926
8 C1y C 28.7750 -16.7870
9 C1y C 22.5367 -17.6815
10 C1y C 28.7750 -18.1668
11 O1a O 27.5824 -20.2482
12 O2a O 29.9853 -16.0913
13 C1y C 22.5367 -19.0731
14 O2x O 21.3322 -16.9916
15 O1a O 29.9678 -18.8626
16 C1y C 21.3322 -19.7630
17 O1a O 23.7293 -19.8330
18 C1x C 20.1338 -17.6815
19 C1y C 20.1338 -19.0731
20 O1a O 21.3381 -21.1485
21 O1a O 18.9352 -19.7687
22 R R 31.1954 -16.7931
BOND 23
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 1 #Down
7 4 8 1
8 9 5 1 #Up
9 6 10 1
10 6 11 1 #Up
11 8 12 1 #Up
12 9 13 1
13 9 14 1
14 10 15 1 #Down
15 13 16 1
16 13 17 1 #Down
17 14 18 1
18 16 19 1
19 16 20 1 #Up
20 19 21 1 #Down
21 8 10 1
22 18 19 1
23 12 22 1
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