Amb2798041
 OpenBabel04142506302D

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    4.2459    0.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2459    1.6235    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3799    2.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5139    1.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5139    0.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6479    0.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7818    0.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7818    1.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6479    2.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.2470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9749    2.0245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4088    1.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9749    0.2225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   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  9  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7 14  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
M  END
>  <Supplier>
www.ambinter.com

>  <Ambinter_reference>
Amb2798041

>  <MW>
193.242

$$$$