Mol:
3.8445 1.3597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4059 1.5238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0595 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5238 0.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 1.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 2.6728 0.0000 O 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 1 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 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 2 0 0 0 0
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
12 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 11 1 0 0 0 0
16 17 2 0 0 0 0
M END
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