431
 OpenBabel09292113292D

 26 28  0  0  1  0  0  0  0  0999 V2000
   -4.7433    1.9483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8479    0.9538    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0388    0.3660    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.0878    0.6750    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.7788    1.6261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5000   -0.1340    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.5000   -0.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000   -1.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.0878   -0.9430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0388   -0.6340    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.8479   -1.2218    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8479   -2.2218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7989   -2.5308    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3867   -1.7218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3812   -1.6172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9690   -2.4262    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9635   -2.3217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5623   -3.3398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7880   -0.7037    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2002    0.1053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2057    0.0008    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7989   -0.9127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  2  1  6  0  0  0
  3  4  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  6  0  0  0
  4  6  1  0  0  0  0
  6  7  1  1  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  1  0  0  0
 15 26  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 26  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 23  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  2  11  -1  12  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
