276
 OpenBabel09292113272D

 21 22  0  0  1  0  0  0  0  0999 V2000
   -7.2749   -2.9851    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4659   -2.3973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5704   -1.4028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7614   -0.8150    0.0000 C   0  0  0  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
   -4.0388   -0.6340    0.0000 C   0  0  1  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
   -4.8479    0.9538    0.0000 O   0  0  0  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  5  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  0  0  0  0  0  0  0  0  0  0  0
   -3.0878   -0.9430    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7433   -2.2163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8298   -2.6230    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5523   -2.8041    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2 21  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5 19  1  0  0  0  0
  6  5  1  1  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  6  0  0  0
  7  9  1  0  0  0  0
  9 10  1  6  0  0  0
  9 11  1  0  0  0  0
 11 12  1  1  0  0  0
 11 18  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  2  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
M  CHG  2  15  -1  16  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
