41
 OpenBabel09292113292D

 21 23  0  0  1  0  0  0  0  0999 V2000
   -4.7261    1.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7261    0.9523    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5921    0.4523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8601    0.4523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8601   -0.5477    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9941   -1.0477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1280   -0.5477    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1280    0.4523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9941    0.9523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7861    1.9305    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7916    2.0350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3849    1.1215    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4067    0.9135    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.3364    1.5827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2024    1.0827    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1160    1.4894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9250    0.9016    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9945    0.1045    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6637   -0.6386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5000   -0.8660    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
  2  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  8  2  0  0  0  0
  8 12  1  0  0  0  0
  8  9  1  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
 13 12  1  6  0  0  0
 13 14  1  0  0  0  0
 13 20  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 18  1  0  0  0  0
 16 17  1  0  0  0  0
 18 19  1  1  0  0  0
 18 20  1  0  0  0  0
 20 21  1  1  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
