90
 OpenBabel09292113373D

 72 76  0  0  1  0  0  0  0  0999 V2000
    6.1841   -1.7738   -4.5566 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6907   -1.0402   -3.5340 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8544   -0.4709   -3.8870 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.5020    0.3050   -3.0096 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5934    0.8559   -3.2292 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8505    0.4823   -1.7185 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6808   -0.1970   -1.5098 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2068    0.1183   -0.2670 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9182   -0.3532    0.2327 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9583   -1.6966    0.9777 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7029   -2.8589    0.1848 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434   -1.5332    2.0033 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5930   -1.9400    1.4159 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8217   -0.0413    2.3049 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.6423    0.3413    3.5386 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5824    1.7502    3.7661 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3593    0.6308    1.1471 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0891    1.0182    0.3197 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1310    1.2823   -0.5794 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2960    2.2543   -0.4650 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5569    1.4955   -0.5453 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8124    2.2646   -0.5715 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.0773    1.2942   -0.6093 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.6765    1.0894   -1.9253 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7678    0.1233   -1.9488 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.3024   -1.2467   -1.4138 C   0  0  3  0  0  0  0  0  0  0  0  0
   13.2351   -1.7583   -2.2217 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4228   -2.2747   -1.4086 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.5051   -1.9728   -0.5069 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9957   -2.4150   -2.8132 C   0  0  2  0  0  0  0  0  0  0  0  0
   17.1252   -3.2962   -2.7526 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3983   -1.0235   -3.3390 C   0  0  3  0  0  0  0  0  0  0  0  0
   16.9303   -1.1804   -4.7790 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4256    0.0469   -5.3149 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2938   -0.0722   -3.2942 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0865    1.9064    0.4014 C   0  0  1  0  0  0  0  0  0  0  0  0
   15.1495    2.6215   -0.2174 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2866    2.8796    1.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0634    3.0522    0.6922 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0674   -0.9989   -2.3906 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9122   -2.0642   -5.2006 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5840   -2.5112   -4.2248 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2349   -0.4081   -0.6299 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9230   -1.8339    1.4760 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7331   -2.9263    0.0787 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9873   -2.1645    2.8846 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2965   -1.2418    0.7994 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7963    0.3252    2.4327 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6958    0.0693    3.4335 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2368   -0.1470    4.4302 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9653    2.1720    2.9724 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8700    1.4411    1.2902 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2107    2.8120    0.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2171    2.9752   -1.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4908    1.0373   -1.4728 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8308    2.9348   -1.4353 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7203    0.3379   -0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5945    0.5344   -1.3621 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9440   -1.1631   -0.3860 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1533   -1.1858   -3.0157 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0334   -3.2469   -1.0887 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4796   -1.0369   -0.2448 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2472   -2.8675   -3.4758 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.4300   -3.2686   -1.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.2168   -0.6086   -2.7369 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1485   -1.5573   -5.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7677   -1.8866   -4.8029 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1232    0.7631   -4.7299 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5216    1.1316    1.0423 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7529    3.0710   -0.9882 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6903    3.4007    2.0532 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3487    3.7463    1.1093 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 41  1  0  0  0  0
  1 42  1  0  0  0  0
  2  3  1  0  0  0  0
  2 40  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7 40  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  9 10  1  0  0  0  0
  9 17  1  0  0  0  0
  9 43  1  6  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 44  1  1  0  0  0
 11 45  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 46  1  1  0  0  0
 13 47  1  0  0  0  0
 14 15  1  0  0  0  0
 14 17  1  0  0  0  0
 14 48  1  1  0  0  0
 15 16  1  0  0  0  0
 15 49  1  0  0  0  0
 15 50  1  0  0  0  0
 16 51  1  0  0  0  0
 18 19  2  0  0  0  0
 18 52  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 53  1  0  0  0  0
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 21 22  1  0  0  0  0
 21 55  1  0  0  0  0
 22 23  1  0  0  0  0
 22 39  1  0  0  0  0
 22 56  1  6  0  0  0
 23 36  1  0  0  0  0
 23 24  1  0  0  0  0
 23 57  1  1  0  0  0
 25 26  1  0  0  0  0
 25 35  1  0  0  0  0
 25 24  1  0  0  0  0
 25 58  1  1  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 59  1  0  0  0  0
 27 60  1  0  0  0  0
 28 30  1  0  0  0  0
 28 29  1  0  0  0  0
 28 61  1  1  0  0  0
 29 62  1  0  0  0  0
 30 32  1  0  0  0  0
 30 31  1  0  0  0  0
 30 63  1  6  0  0  0
 31 64  1  0  0  0  0
 32 33  1  0  0  0  0
 32 35  1  0  0  0  0
 32 65  1  0  0  0  0
 33 34  1  0  0  0  0
 33 66  1  0  0  0  0
 33 67  1  0  0  0  0
 34 68  1  0  0  0  0
 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
 36 69  1  1  0  0  0
 37 70  1  0  0  0  0
 38 39  2  0  0  0  0
 38 71  1  0  0  0  0
 39 72  1  0  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
