COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.267  -3.089  -1.986  1.00  0.00           C  
HETATM    2  C   UNL     1       8.104  -2.107  -1.829  1.00  0.00           C  
HETATM    3  C   UNL     1       7.786  -1.937  -0.366  1.00  0.00           C  
HETATM    4  O   UNL     1       8.425  -2.542   0.469  1.00  0.00           O  
HETATM    5  N   UNL     1       6.789  -1.113   0.015  1.00  0.00           N  
HETATM    6  C   UNL     1       6.193  -0.692   1.292  1.00  0.00           C  
HETATM    7  C   UNL     1       4.882  -0.440   0.534  1.00  0.00           C  
HETATM    8  C   UNL     1       5.825  -0.233  -0.662  1.00  0.00           C  
HETATM    9  N   UNL     1       4.171   0.771   0.951  1.00  0.00           N  
HETATM   10  C   UNL     1       2.838   0.865   0.774  1.00  0.00           C  
HETATM   11  O   UNL     1       2.228  -0.053   0.269  1.00  0.00           O  
HETATM   12  C   UNL     1       2.107   2.111   1.202  1.00  0.00           C  
HETATM   13  N   UNL     1       0.680   1.967   0.904  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.246   1.487   1.770  1.00  0.00           C  
HETATM   15  C   UNL     1       0.039   1.025   3.175  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.036   0.192   3.877  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.792   1.641   4.303  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.474   1.486   1.177  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.740   1.043   1.778  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.436   1.836   2.382  1.00  0.00           O  
HETATM   21  N   UNL     1      -3.129  -0.242   1.658  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.391  -0.717   2.248  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.306  -1.158   1.107  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.566  -2.039   0.135  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.323  -2.857  -0.703  1.00  0.00           C  
HETATM   26  O   UNL     1      -6.678  -2.846  -0.612  1.00  0.00           O  
HETATM   27  C   UNL     1      -7.395  -3.707  -1.498  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.702  -3.680  -1.627  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.324  -3.689  -1.722  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.575  -2.881  -0.891  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.193  -2.059   0.042  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.315  -1.221   0.930  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.282   2.017  -0.185  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.135   2.258  -1.259  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.627   2.776  -2.431  1.00  0.00           C  
HETATM   36 CL   UNL     1      -2.686   3.078  -3.773  1.00  0.00          Cl  
HETATM   37  C   UNL     1      -0.272   3.056  -2.543  1.00  0.00           C  
HETATM   38  C   UNL     1       0.583   2.822  -1.488  1.00  0.00           C  
HETATM   39  C   UNL     1       2.051   3.131  -1.625  1.00  0.00           C  
HETATM   40  C   UNL     1       0.088   2.305  -0.295  1.00  0.00           C  
HETATM   41  H   UNL     1      10.143  -2.702  -1.466  1.00  0.00           H  
HETATM   42  H   UNL     1       8.989  -4.053  -1.561  1.00  0.00           H  
HETATM   43  H   UNL     1       9.498  -3.213  -3.044  1.00  0.00           H  
HETATM   44  H   UNL     1       8.383  -1.143  -2.254  1.00  0.00           H  
HETATM   45  H   UNL     1       7.228  -2.495  -2.349  1.00  0.00           H  
HETATM   46  H   UNL     1       6.123  -1.497   2.024  1.00  0.00           H  
HETATM   47  H   UNL     1       6.639   0.214   1.702  1.00  0.00           H  
HETATM   48  H   UNL     1       4.235  -1.314   0.456  1.00  0.00           H  
HETATM   49  H   UNL     1       6.174   0.794  -0.768  1.00  0.00           H  
HETATM   50  H   UNL     1       5.442  -0.646  -1.595  1.00  0.00           H  
HETATM   51  H   UNL     1       4.659   1.506   1.355  1.00  0.00           H  
HETATM   52  H   UNL     1       2.241   2.260   2.274  1.00  0.00           H  
HETATM   53  H   UNL     1       2.506   2.970   0.663  1.00  0.00           H  
HETATM   54  H   UNL     1       1.081   0.787   3.390  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.949  -0.022   3.321  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.701  -0.595   4.553  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.297   1.807   5.260  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.544   2.380   4.028  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.194  -1.561   2.910  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.863   0.090   2.809  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.152  -1.710   1.518  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.674  -0.277   0.582  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.466  -3.601  -1.322  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.168  -3.437  -2.530  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.098  -4.741  -1.320  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.294  -4.314  -2.271  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.835  -4.326  -2.443  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.498  -2.887  -0.968  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.577  -0.698   0.322  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.803  -1.865   1.646  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.190   2.040  -1.174  1.00  0.00           H  
HETATM   72  H   UNL     1       0.116   3.461  -3.466  1.00  0.00           H  
HETATM   73  H   UNL     1       2.254   4.121  -1.216  1.00  0.00           H  
HETATM   74  H   UNL     1       2.631   2.387  -1.079  1.00  0.00           H  
HETATM   75  H   UNL     1       2.331   3.108  -2.678  1.00  0.00           H  
CONECT    1    2   41   42   43                                       
CONECT    2    1    3   44   45                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    8                                            
CONECT    6    5    7   46   47                                       
CONECT    7    6    8    9   48                                       
CONECT    8    5    7   49   50                                       
CONECT    9    7   10   51                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   52   53                                       
CONECT   13   12   40   14                                            
CONECT   14   13   15   18   18                                       
CONECT   15   16   14   17   54                                       
CONECT   16   15   17   55   56                                       
CONECT   17   16   15   57   58                                       
CONECT   18   14   14   33   19                                       
CONECT   19   18   21   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   32   19   22                                            
CONECT   22   21   23   59   60                                       
CONECT   23   24   22   61   62                                       
CONECT   24   31   31   25   23                                       
CONECT   25   28   28   24   26                                       
CONECT   26   25   27                                                 
CONECT   27   26   63   64   65                                       
CONECT   28   29   25   25   66                                       
CONECT   29   30   30   28   67                                       
CONECT   30   29   29   31   68                                       
CONECT   31   30   32   24   24                                       
CONECT   32   31   21   69   70                                       
CONECT   33   40   40   34   18                                       
CONECT   34   35   35   33   71                                       
CONECT   35   37   36   34   34                                       
CONECT   36   35                                                      
CONECT   37   38   38   35   72                                       
CONECT   38   39   37   37   40                                       
CONECT   39   38   73   74   75                                       
CONECT   40   38   13   33   33                                       
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    2                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   34                                                      
CONECT   72   37                                                      
CONECT   73   39                                                      
CONECT   74   39                                                      
CONECT   75   39                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
