Amb19958816
 OpenBabel05062519262D

 12 12  0  0  0  0  0  0  0  0999 V2000
    3.9895   -2.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1974   -1.3080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1485   -0.9990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4543   -0.6389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5032   -0.9479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7601   -0.2788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9680    0.6994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8090   -0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -1.5388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -1.5388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8090   -0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  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
  6  8  1  0  0  0  0
  8 12  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
M  END
>  <Supplier>
www.ambinter.com

>  <Ambinter_reference>
Amb19958816

>  <MW>
166.174

$$$$