412
 OpenBabel09292113292D

 27 29  0  0  1  0  0  0  0  0999 V2000
   -5.4388    3.9570    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1079    3.2139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0861    3.4218    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7989    2.2628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8479    1.9538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8479    0.9538    0.0000 N   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 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5000   -0.1340    0.0000 C   0  0  2  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 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.7788   -1.8940    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 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7989    0.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2057   -0.2688    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2002   -0.3733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6069   -1.2868    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7880    0.4357    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3812    1.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9690    2.1583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3867    1.4538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4 27  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6 20  1  0  0  0  0
  7  6  1  6  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  6  0  0  0
  9 16  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  1  0  0  0
 16 18  1  0  0  0  0
 18 19  1  1  0  0  0
 20 27  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
M  CHG  2  14  -1  15  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
