426
 OpenBabel09292113383D

 44 47  0  0  1  0  0  0  0  0999 V2000
    1.5803    0.3981   -0.0899 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0337    0.0739   -0.0926 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5418   -1.1960   -0.1038 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9036   -1.0634   -0.1003 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8546   -2.0720   -0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4402   -3.2452   -0.1134 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2284   -1.6621   -0.1325 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2983   -2.4881   -0.1835 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3268   -1.6814   -0.2005 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9735   -0.3388   -0.1224 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0377    0.6657   -0.0056 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.2503    0.2181   -0.6798 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4305    0.5938    0.0882 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.2271   -0.6250    0.5733 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7639   -1.4510   -0.5061 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6646   -2.7968    0.1024 P   0  0  0  0  0  0  0  0  0  0  0  0
   15.5938   -1.7452    0.7512 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3405   -3.2750    0.7376 O   0  5  0  0  0  0  0  0  0  0  0  0
   15.5654   -4.1427    0.7109 O   0  5  0  0  0  0  0  0  0  0  0  0
   11.9001    1.4665    1.2393 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.8093    2.8708    0.8573 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4546    0.9989    1.4253 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6494    2.0604    1.9640 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5673   -0.3031   -0.1157 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5712    0.6777   -0.0892 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8180    2.1109   -0.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2144    0.2976   -0.0878 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0807    1.0012   -0.0846 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9943   -0.5344   -0.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2789    0.9491   -0.9845 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2845    0.9540    0.8033 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0725   -2.1731   -0.1138 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3644   -2.0061   -0.2548 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7205    1.5564   -0.5498 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0662    1.1902   -0.5749 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5510   -1.2113    1.1954 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0454   -0.2706    1.2193 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.4927    1.4301    2.1618 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9976    2.9189   -0.0977 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4130    0.1345    2.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1824    2.8702    1.8015 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8732    2.3768   -0.1249 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3874    2.5880    0.7868 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3609    2.5726   -0.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  1 31  1  0  0  0  0
  2  3  2  0  0  0  0
  2 28  1  0  0  0  0
  3  4  1  0  0  0  0
  3 32  1  0  0  0  0
  4  5  1  0  0  0  0
  4 27  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 24  2  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 33  1  0  0  0  0
 10 11  1  0  0  0  0
 10 24  1  0  0  0  0
 11 12  1  0  0  0  0
 11 22  1  0  0  0  0
 11 34  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 20  1  0  0  0  0
 13 35  1  6  0  0  0
 14 15  1  0  0  0  0
 14 36  1  0  0  0  0
 14 37  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 38  1  1  0  0  0
 21 39  1  0  0  0  0
 22 23  1  0  0  0  0
 22 40  1  1  0  0  0
 23 41  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 42  1  0  0  0  0
 26 43  1  0  0  0  0
 26 44  1  0  0  0  0
 27 28  2  0  0  0  0
M  CHG  2  18  -1  19  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
