COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.743   3.356  -0.569  1.00  0.00           C  
HETATM    2  C   UNL     1       3.406   3.110  -0.325  1.00  0.00           C  
HETATM    3  C   UNL     1       3.020   1.937   0.297  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.001  -0.444   0.232  1.00  0.00           N  
HETATM    5  C   UNL     1       1.560   1.671   0.561  1.00  0.00           C  
HETATM    6  C   UNL     1       0.950   0.938  -0.635  1.00  0.00           C  
HETATM    7  N   UNL     1       0.721  -3.754   0.101  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.510   0.672  -0.370  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.667   0.930  -0.306  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.994   1.354  -0.397  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.006   0.544   0.099  1.00  0.00           C  
HETATM   12  N   UNL     1      -8.532   1.127  -0.518  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.699  -0.686   0.687  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.402  -1.106   0.780  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.375  -0.310   0.289  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.394  -0.826  -1.617  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.478   0.398  -0.742  1.00  0.00           C  
HETATM   18  O   UNL     1      -8.295   2.046   0.229  1.00  0.00           O  
HETATM   19  C   UNL     1      -7.011   2.056   0.616  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.353   3.047   1.541  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.420   0.987   0.005  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.483   1.476  -0.685  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.219  -1.581   0.725  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.063  -2.614  -0.392  1.00  0.00           C  
HETATM   25  C   UNL     1       0.693  -4.868  -0.858  1.00  0.00           C  
HETATM   26  C   UNL     1       1.471  -6.053  -0.278  1.00  0.00           C  
HETATM   27  O   UNL     1       2.804  -5.637   0.030  1.00  0.00           O  
HETATM   28  C   UNL     1       2.868  -4.554   0.962  1.00  0.00           C  
HETATM   29  C   UNL     1       2.105  -3.354   0.395  1.00  0.00           C  
HETATM   30  C   UNL     1       3.970   1.007   0.675  1.00  0.00           C  
HETATM   31  C   UNL     1       5.309   1.248   0.433  1.00  0.00           C  
HETATM   32  C   UNL     1       5.699   2.425  -0.190  1.00  0.00           C  
HETATM   33  O   UNL     1       7.014   2.662  -0.435  1.00  0.00           O  
HETATM   34  C   UNL     1       7.943   1.659  -0.017  1.00  0.00           C  
HETATM   35  C   UNL     1       9.364   2.099  -0.375  1.00  0.00           C  
HETATM   36  C   UNL     1      10.358   1.025   0.073  1.00  0.00           C  
HETATM   37  H   UNL     1       5.044   4.271  -1.059  1.00  0.00           H  
HETATM   38  H   UNL     1       2.661   3.835  -0.620  1.00  0.00           H  
HETATM   39  H   UNL     1       1.459   1.055   1.455  1.00  0.00           H  
HETATM   40  H   UNL     1       1.040   2.617   0.712  1.00  0.00           H  
HETATM   41  H   UNL     1       1.051   1.554  -1.528  1.00  0.00           H  
HETATM   42  H   UNL     1       1.470  -0.008  -0.785  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.232   2.304  -0.851  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.492  -1.310   1.071  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.174  -2.058   1.237  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.613  -1.713  -1.023  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.119  -0.744  -2.427  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.391  -0.906  -2.034  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.088   3.784   1.865  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.955   2.524   2.411  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.541   3.550   1.016  1.00  0.00           H  
HETATM   52  H   UNL     1       0.765  -1.235   1.041  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.733  -2.036   1.571  1.00  0.00           H  
HETATM   54  H   UNL     1       0.451  -2.159  -1.239  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.047  -2.960  -0.708  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.339  -5.165  -1.041  1.00  0.00           H  
HETATM   57  H   UNL     1       1.153  -4.553  -1.794  1.00  0.00           H  
HETATM   58  H   UNL     1       0.979  -6.402   0.630  1.00  0.00           H  
HETATM   59  H   UNL     1       1.501  -6.861  -1.010  1.00  0.00           H  
HETATM   60  H   UNL     1       2.417  -4.859   1.906  1.00  0.00           H  
HETATM   61  H   UNL     1       3.910  -4.278   1.128  1.00  0.00           H  
HETATM   62  H   UNL     1       2.588  -3.015  -0.521  1.00  0.00           H  
HETATM   63  H   UNL     1       2.103  -2.546   1.127  1.00  0.00           H  
HETATM   64  H   UNL     1       3.666   0.092   1.161  1.00  0.00           H  
HETATM   65  H   UNL     1       6.051   0.522   0.729  1.00  0.00           H  
HETATM   66  H   UNL     1       7.866   1.519   1.061  1.00  0.00           H  
HETATM   67  H   UNL     1       7.715   0.720  -0.522  1.00  0.00           H  
HETATM   68  H   UNL     1       9.441   2.239  -1.453  1.00  0.00           H  
HETATM   69  H   UNL     1       9.591   3.037   0.131  1.00  0.00           H  
HETATM   70  H   UNL     1      11.370   1.339  -0.182  1.00  0.00           H  
HETATM   71  H   UNL     1      10.281   0.885   1.151  1.00  0.00           H  
HETATM   72  H   UNL     1      10.130   0.086  -0.432  1.00  0.00           H  
CONECT    1    2   32   32   37                                       
CONECT    2    3    3    1   38                                       
CONECT    3    5    2    2   30                                       
CONECT    4    8   23   15                                            
CONECT    5    6    3   39   40                                       
CONECT    6    5    8   41   42                                       
CONECT    7   25   29   24                                            
CONECT    8    6   22   22    4                                       
CONECT    9   22   15   15   10                                       
CONECT   10    9   11   11   43                                       
CONECT   11   10   10   13   21                                       
CONECT   12   17   17   18                                            
CONECT   13   14   14   11   44                                       
CONECT   14   15   13   13   45                                       
CONECT   15    4    9    9   14                                       
CONECT   16   17   46   47   48                                       
CONECT   17   16   21   12   12                                       
CONECT   18   12   19                                                 
CONECT   19   21   21   18   20                                       
CONECT   20   19   49   50   51                                       
CONECT   21   11   17   19   19                                       
CONECT   22    8    8    9                                            
CONECT   23   24    4   52   53                                       
CONECT   24    7   23   54   55                                       
CONECT   25   26    7   56   57                                       
CONECT   26   27   25   58   59                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   60   61                                       
CONECT   29   28    7   62   63                                       
CONECT   30    3   31   31   64                                       
CONECT   31   30   30   32   65                                       
CONECT   32    1    1   33   31                                       
CONECT   33   32   34                                                 
CONECT   34   33   35   66   67                                       
CONECT   35   36   34   68   69                                       
CONECT   36   35   70   71   72                                       
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69   35                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
CONECT   72   36                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
