376
 OpenBabel09292113323D

 59 61  0  0  1  0  0  0  0  0999 V2000
    0.2871    0.4585   -3.7090 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9701    0.9583   -2.4404 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9220   -0.0860   -1.8313 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.9278   -0.4122   -2.8031 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5926    0.3456   -0.5019 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.4619    1.5089   -0.6756 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5859    1.7600    0.0617 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9773    1.0107    0.9415 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2343    2.9227   -0.2456 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7946    3.9383   -1.1067 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5226    3.9232   -1.6033 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1397    4.9038   -2.4493 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4526    4.8296   -3.0077 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4504    6.2394   -4.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9109    5.8838   -2.9228 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1504    5.8576   -2.4156 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6598    4.9589   -1.5032 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9726    5.2465   -1.2203 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2637    6.2975   -1.9736 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1901    6.6817   -2.7371 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1109    7.6901   -3.7736 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3547    7.7828   -4.4802 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7114    9.1817   -4.5930 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.7984    9.5612   -3.6051 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0163    8.8631   -3.8979 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2993    9.3109   -2.8273 P   0  0  0  0  0  0  0  0  0  0  0  0
   11.1572   10.7328   -3.4166 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3990    8.7728   -1.6904 O   0  5  0  0  0  0  0  0  0  0  0  0
   12.5823    9.7586   -1.7566 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.4237    9.9589   -4.3037 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5606   10.0242   -5.4692 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7075    9.0809   -3.2867 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2871    9.3027   -3.3543 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5071    0.6286    0.5462 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6740   -0.1877    0.9080 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4951    1.9122    0.9878 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3789    1.2310   -4.1077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3125   -0.4339   -3.5053 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0167    0.2152   -4.4877 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1982    1.2470   -1.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5294    1.8583   -2.7074 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3560   -1.0076   -1.6516 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3703    0.4147   -3.0666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2182   -0.4690   -0.1177 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2723    2.1693   -1.4283 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1429    3.0631    0.1846 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4666    6.3181   -4.6141 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1943    6.1004   -4.9349 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6515    7.1703   -3.6072 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2277    6.8013   -2.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3813    7.3236   -4.5085 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0699    9.3372   -5.6155 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4580    9.3353   -2.5915 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9500   10.6428   -3.6831 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5716   10.9846   -3.9531 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0885    9.7135   -6.2281 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0413    9.2717   -2.2622 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1481    9.6968   -4.2431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2368    2.4162    0.5877 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  1 39  1  0  0  0  0
  2  3  1  0  0  0  0
  2 40  1  0  0  0  0
  2 41  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 42  1  0  0  0  0
  4 43  1  0  0  0  0
  5  6  1  0  0  0  0
  5 34  1  0  0  0  0
  5 44  1  0  0  0  0
  6  7  1  0  0  0  0
  6 45  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 46  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  2  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 12 15  1  0  0  0  0
 13 14  1  0  0  0  0
 14 47  1  0  0  0  0
 14 48  1  0  0  0  0
 14 49  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 20  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 19 50  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 32  1  0  0  0  0
 21 51  1  6  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 30  1  0  0  0  0
 23 52  1  6  0  0  0
 24 25  1  0  0  0  0
 24 53  1  0  0  0  0
 24 54  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 55  1  1  0  0  0
 31 56  1  0  0  0  0
 32 33  1  0  0  0  0
 32 57  1  1  0  0  0
 33 58  1  0  0  0  0
 34 35  2  0  0  0  0
 34 36  1  0  0  0  0
 36 59  1  0  0  0  0
M  CHG  2  28  -1  29  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
