Amb3941252
 OpenBabel04162511432D

 12 13  0  0  0  0  0  0  0  0999 V2000
    3.1042    2.9680    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1261    2.7601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4570    3.5032    0.0000 O   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
    2.4049    1.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8171    0.1910    0.0000 N   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
    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  2  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 12  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Supplier>
www.ambinter.com

>  <Ambinter_reference>
Amb3941252

>  <MW>
166.177

$$$$