442
 OpenBabel09292113292D

 27 29  0  0  1  0  0  0  0  0999 V2000
    7.6267   -0.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7312    0.5551    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9222    1.1428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0267    2.1374    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.2177    2.7251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3222    3.7197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3041    2.3184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1996    1.3239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2215    1.1160    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8147    0.2024    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3147   -0.6636    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.3092   -0.7681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7160   -1.6817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6456   -1.4067    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.8535   -2.3849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7321   -1.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8660   -1.5000    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
    1.0000    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.0000    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
    2.8366   -0.0055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7215    1.9820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3906    2.7251    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.1827    3.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0086    0.7361    0.0000 N   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 27  2  0  0  0  0
  3  4  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 25  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 27  1  0  0  0  0
  9 24  1  0  0  0  0
 10  9  1  1  0  0  0
 10 11  1  0  0  0  0
 10 23  1  0  0  0  0
 11 12  1  6  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  1  6  0  0  0
 14 16  1  0  0  0  0
 16 17  1  1  0  0  0
 16 23  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  3  21  -1  22  -1  25   1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
