Amb8850833
 OpenBabel05192520292D

 12 12  0  0  0  0  0  0  0  0999 V2000
    4.2731    0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2731    1.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4071    2.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5411    1.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6750    2.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8090    1.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0570    2.0878    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
    1.6180    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3090   -0.9511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3090   -0.9511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 S   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
  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  2  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Supplier>
www.ambinter.com

>  <Ambinter_reference>
Amb8850833

>  <MW>
182.283

$$$$