ATOM 13
1 O1a O 28.1694 -21.0824
2 C1y C 28.1694 -19.6772
3 C1y C 26.9652 -18.9811
4 C1y C 29.3878 -18.9811
5 C1y C 26.9652 -17.5817
6 O1a O 25.7539 -19.6772
7 C1y C 29.3878 -17.5817
8 O1a O 30.5990 -19.6772
9 O2x O 28.1694 -16.8785
10 C1b C 25.7539 -16.8785
11 O2a O 30.5990 -16.8785
12 R R 31.8104 -17.5817
13 O1a O 24.5383 -17.5825
BOND 13
1 2 1 1 #Up
2 2 3 1
3 2 4 1
4 3 5 1
5 3 6 1 #Down
6 4 7 1
7 4 8 1 #Up
8 5 9 1
9 5 10 1 #Up
10 7 11 1 #Up
11 11 12 1
12 7 9 1
13 10 13 1
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