COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.602   3.004   1.688  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.370   1.656   1.057  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.197   0.988   0.979  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.404  -0.212   0.343  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.696  -0.339   0.003  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.359   0.814   0.406  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.788   1.012   0.158  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.376   1.997   0.558  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.506  -0.068  -0.625  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.898  -1.436  -0.330  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.409  -1.475  -0.684  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.081  -1.769   1.151  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.632  -2.491  -1.166  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.426  -1.177   0.091  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.573  -2.083  -0.959  1.00  0.00           C  
HETATM   16  C   UNL     1       0.398  -3.005  -1.225  1.00  0.00           C  
HETATM   17  C   UNL     1       1.589  -3.022  -0.485  1.00  0.00           C  
HETATM   18  C   UNL     1       1.768  -2.082   0.533  1.00  0.00           C  
HETATM   19  C   UNL     1       0.710  -1.253   0.878  1.00  0.00           C  
HETATM   20  N   UNL     1       2.990  -1.913   1.195  1.00  0.00           N  
HETATM   21  C   UNL     1       3.203  -0.584   1.819  1.00  0.00           C  
HETATM   22  C   UNL     1       3.222   0.471   0.708  1.00  0.00           C  
HETATM   23  C   UNL     1       2.859   1.845   1.270  1.00  0.00           C  
HETATM   24  N   UNL     1       1.977   2.562   0.320  1.00  0.00           N  
HETATM   25  C   UNL     1       0.563   2.747   0.736  1.00  0.00           C  
HETATM   26  C   UNL     1       0.113   1.506   1.507  1.00  0.00           C  
HETATM   27  C   UNL     1       2.423   3.042  -0.862  1.00  0.00           C  
HETATM   28  O   UNL     1       3.606   3.000  -1.127  1.00  0.00           O  
HETATM   29  C   UNL     1       1.450   3.628  -1.852  1.00  0.00           C  
HETATM   30  C   UNL     1       0.620   2.506  -2.478  1.00  0.00           C  
HETATM   31  N   UNL     1       2.190   4.335  -2.906  1.00  0.00           N  
HETATM   32  C   UNL     1       4.631   0.521   0.106  1.00  0.00           C  
HETATM   33  C   UNL     1       4.548  -0.580   2.548  1.00  0.00           C  
HETATM   34  C   UNL     1       2.624  -4.023  -0.793  1.00  0.00           C  
HETATM   35  O   UNL     1       3.660  -4.044  -0.155  1.00  0.00           O  
HETATM   36  N   UNL     1       2.424  -4.917  -1.782  1.00  0.00           N  
HETATM   37  H   UNL     1      -2.459   3.784   0.940  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.620   3.053   2.074  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.896   3.149   2.505  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.561  -0.073  -0.346  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.421   0.144  -1.692  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.291  -1.382  -1.765  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.985  -2.425  -0.353  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.144  -1.786   1.392  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.646  -2.747   1.360  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.583  -1.013   1.758  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.521  -2.257  -2.224  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.206  -3.474  -0.964  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.690  -2.492  -0.903  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.455  -2.056  -1.580  1.00  0.00           H  
HETATM   51  H   UNL     1       0.247  -3.734  -2.008  1.00  0.00           H  
HETATM   52  H   UNL     1       0.743  -0.749   1.835  1.00  0.00           H  
HETATM   53  H   UNL     1       3.662  -2.609   1.257  1.00  0.00           H  
HETATM   54  H   UNL     1       2.404  -0.370   2.523  1.00  0.00           H  
HETATM   55  H   UNL     1       2.512   0.192  -0.068  1.00  0.00           H  
HETATM   56  H   UNL     1       2.361   1.736   2.233  1.00  0.00           H  
HETATM   57  H   UNL     1       3.776   2.429   1.413  1.00  0.00           H  
HETATM   58  H   UNL     1       0.489   3.624   1.376  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.061   2.879  -0.146  1.00  0.00           H  
HETATM   60  H   UNL     1       0.003   1.757   2.565  1.00  0.00           H  
HETATM   61  H   UNL     1       0.894   0.759   1.401  1.00  0.00           H  
HETATM   62  H   UNL     1       0.788   4.328  -1.341  1.00  0.00           H  
HETATM   63  H   UNL     1       0.092   1.963  -1.693  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.103   2.932  -3.174  1.00  0.00           H  
HETATM   65  H   UNL     1       1.278   1.821  -3.013  1.00  0.00           H  
HETATM   66  H   UNL     1       1.559   4.738  -3.583  1.00  0.00           H  
HETATM   67  H   UNL     1       2.795   5.040  -2.512  1.00  0.00           H  
HETATM   68  H   UNL     1       5.347   0.797   0.880  1.00  0.00           H  
HETATM   69  H   UNL     1       4.889  -0.460  -0.295  1.00  0.00           H  
HETATM   70  H   UNL     1       4.658   1.260  -0.695  1.00  0.00           H  
HETATM   71  H   UNL     1       5.348  -0.782   1.836  1.00  0.00           H  
HETATM   72  H   UNL     1       4.709   0.395   3.008  1.00  0.00           H  
HETATM   73  H   UNL     1       4.546  -1.349   3.320  1.00  0.00           H  
HETATM   74  H   UNL     1       1.598  -4.901  -2.290  1.00  0.00           H  
HETATM   75  H   UNL     1       3.105  -5.577  -1.985  1.00  0.00           H  
CONECT    1    2   37   38   39                                       
CONECT    2    1    3    3    6                                       
CONECT    3   26    2    2    4                                       
CONECT    4    3    5   14                                            
CONECT    5    6    6    4   11                                       
CONECT    6    2    7    5    5                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   40   41                                       
CONECT   10    9   11   13   12                                       
CONECT   11    5   10   42   43                                       
CONECT   12   10   44   45   46                                       
CONECT   13   10   47   48   49                                       
CONECT   14   15    4   19   19                                       
CONECT   15   16   16   14   50                                       
CONECT   16   15   15   17   51                                       
CONECT   17   16   34   18   18                                       
CONECT   18   17   17   19   20                                       
CONECT   19   14   14   18   52                                       
CONECT   20   18   21   53                                            
CONECT   21   22   20   33   54                                       
CONECT   22   32   23   21   55                                       
CONECT   23   24   22   56   57                                       
CONECT   24   27   25   23                                            
CONECT   25   26   24   58   59                                       
CONECT   26    3   25   60   61                                       
CONECT   27   28   28   29   24                                       
CONECT   28   27   27                                                 
CONECT   29   31   27   30   62                                       
CONECT   30   29   63   64   65                                       
CONECT   31   29   66   67                                            
CONECT   32   22   68   69   70                                       
CONECT   33   21   71   72   73                                       
CONECT   34   36   17   35   35                                       
CONECT   35   34   34                                                 
CONECT   36   34   74   75                                            
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   33                                                      
CONECT   73   33                                                      
CONECT   74   36                                                      
CONECT   75   36                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
