Mol:
0 0 0 0 0
9.5197 3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8793 4.7100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5197 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8793 1.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.8793 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1600 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1600 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8004 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 3 2 0 0 0 0
8 9 1 0 0 0 0
5 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
14 16 1 0 0 0 0
16 10 2 0 0 0 0
13 17 2 0 0 0 0
17 18 1 0 0 0 0
17 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
19 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
24 12 2 0 0 0 0
M END
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