Amb10071756
 OpenBabel04112501482D

 12 13  0  0  0  0  0  0  0  0999 V2000
   -3.9049   -0.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4049   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9049   -1.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4049   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8171   -0.1910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8171   -1.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -0.5000    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  8  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6 12  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  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>
Amb10071756

>  <MW>
160.212

$$$$