Amb22173599
 OpenBabel04112506442D

 17 18  0  0  1  0  0  0  0  0999 V2000
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   -3.5491   -0.1910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5491   -1.1910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6831    0.3090    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -2.6831    1.3090    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -4.1831    2.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    1.6180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5878    0.8090    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
    0.3090   -0.9511    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 10  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7 16  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 14  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
M  END
>  <Supplier>
www.ambinter.com

>  <Ambinter_reference>
Amb22173599

>  <MW>
230.302

$$$$