95
 OpenBabel09292113353D

 18 19  0  0  0  0  0  0  0  0999 V2000
    1.1818   -0.0161   -0.1074 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5331   -0.0514   -0.0938 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1544    1.1806   -0.0904 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5223    1.3680   -0.0822 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0329    2.4800   -0.0805 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2564    0.1345   -0.0742 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6296   -0.1922   -0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7057   -1.5746   -0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4216   -2.0765   -0.0715 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5336   -1.0368   -0.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1857   -1.1824   -0.0861 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7483    0.7013   -0.0608 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6784    1.3946   -0.0568 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6478    0.8395   -0.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6746   -0.8918   -0.0897 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6074    2.0237   -0.0989 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5570   -2.2437   -0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1618   -3.0539   -0.0745 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 11  2  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  2  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  3  0  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
