COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.712  -0.699  -0.096  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.949  -1.132   1.902  1.00  0.00           C  
HETATM    3  C   UNL     1     -10.964   0.209   1.906  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.864   0.531  -0.207  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.747  -1.468  -1.234  1.00  0.00           C  
HETATM    6  C   UNL     1       0.933   2.069  -0.971  1.00  0.00           C  
HETATM    7  C   UNL     1       3.061   0.964  -1.231  1.00  0.00           C  
HETATM    8  C   UNL     1       3.288  -1.252  -2.129  1.00  0.00           C  
HETATM    9  C   UNL     1       0.831   4.591  -0.938  1.00  0.00           C  
HETATM   10  C   UNL     1       0.171   3.237  -0.900  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.202   3.122  -0.796  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.003   0.826  -0.835  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.990  -0.512  -0.569  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.602   0.349   0.333  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.960   0.253   0.567  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.194  -0.797   0.157  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.442  -1.094   1.639  1.00  0.00           C  
HETATM   18  C   UNL     1      -9.359   0.446   0.109  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.106  -1.560  -0.997  1.00  0.00           C  
HETATM   20  C   UNL     1       2.551  -0.093  -1.975  1.00  0.00           C  
HETATM   21  C   UNL     1       4.534  -1.364  -1.543  1.00  0.00           C  
HETATM   22  C   UNL     1       5.056  -0.305  -0.807  1.00  0.00           C  
HETATM   23  C   UNL     1       5.541  -0.643   2.402  1.00  0.00           C  
HETATM   24  C   UNL     1       4.081  -0.484   1.974  1.00  0.00           C  
HETATM   25  C   UNL     1       5.720  -0.093   3.818  1.00  0.00           C  
HETATM   26  C   UNL     1       5.921  -2.125   2.378  1.00  0.00           C  
HETATM   27  C   UNL     1       4.315   0.857  -0.647  1.00  0.00           C  
HETATM   28  F   UNL     1      -5.843  -2.489  -1.643  1.00  0.00           F  
HETATM   29  N   UNL     1      -1.751   1.917  -0.766  1.00  0.00           N  
HETATM   30  N   UNL     1      -1.616  -0.416  -0.807  1.00  0.00           N  
HETATM   31  N   UNL     1      -9.543   0.161   1.538  1.00  0.00           N  
HETATM   32  N   UNL     1       0.315   0.892  -0.941  1.00  0.00           N  
HETATM   33  N   UNL     1       2.314   2.136  -1.076  1.00  0.00           N  
HETATM   34  N   UNL     1       6.319  -0.416  -0.220  1.00  0.00           N  
HETATM   35  O   UNL     1       6.155   1.612   1.115  1.00  0.00           O  
HETATM   36  O   UNL     1       7.977  -0.013   1.515  1.00  0.00           O  
HETATM   37  S   UNL     1       6.609   0.273   1.257  1.00  0.00           S  
HETATM   38 CL   UNL     1       5.456  -2.822  -1.737  1.00  0.00          Cl  
HETATM   39  H   UNL     1      -9.402  -1.921   1.303  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.128  -1.329   2.959  1.00  0.00           H  
HETATM   41  H   UNL     1     -11.066   0.068   2.982  1.00  0.00           H  
HETATM   42  H   UNL     1     -11.380   1.177   1.625  1.00  0.00           H  
HETATM   43  H   UNL     1     -11.502  -0.582   1.383  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.415   1.337   0.373  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.727   0.728  -1.271  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.274  -2.139  -1.936  1.00  0.00           H  
HETATM   47  H   UNL     1       2.888  -2.071  -2.707  1.00  0.00           H  
HETATM   48  H   UNL     1       0.911   4.928  -1.971  1.00  0.00           H  
HETATM   49  H   UNL     1       0.232   5.303  -0.369  1.00  0.00           H  
HETATM   50  H   UNL     1       1.827   4.523  -0.500  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.820   4.006  -0.739  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.016   1.093   0.851  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.435   0.923   1.268  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.616  -1.597  -0.451  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.985  -0.314   2.248  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.003  -2.059   1.895  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.837   1.395  -0.136  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.811  -0.351  -0.481  1.00  0.00           H  
HETATM   59  H   UNL     1       1.577  -0.008  -2.434  1.00  0.00           H  
HETATM   60  H   UNL     1       3.953  -0.876   0.965  1.00  0.00           H  
HETATM   61  H   UNL     1       3.439  -1.035   2.662  1.00  0.00           H  
HETATM   62  H   UNL     1       3.810   0.572   1.991  1.00  0.00           H  
HETATM   63  H   UNL     1       5.450   0.963   3.835  1.00  0.00           H  
HETATM   64  H   UNL     1       5.078  -0.644   4.506  1.00  0.00           H  
HETATM   65  H   UNL     1       6.761  -0.206   4.123  1.00  0.00           H  
HETATM   66  H   UNL     1       6.961  -2.239   2.683  1.00  0.00           H  
HETATM   67  H   UNL     1       5.279  -2.676   3.066  1.00  0.00           H  
HETATM   68  H   UNL     1       5.793  -2.517   1.369  1.00  0.00           H  
HETATM   69  H   UNL     1       4.714   1.677  -0.068  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.092  -1.219  -0.953  1.00  0.00           H  
HETATM   71  H   UNL     1       2.762   2.996  -1.042  1.00  0.00           H  
HETATM   72  H   UNL     1       7.026  -0.897  -0.678  1.00  0.00           H  
CONECT    1   16   15   15   19                                       
CONECT    2   31   17   39   40                                       
CONECT    3   31   41   42   43                                       
CONECT    4   18   16   44   45                                       
CONECT    5   19   19   13   46                                       
CONECT    6   32   33   10   10                                       
CONECT    7   27   20   20   33                                       
CONECT    8   21   21   20   47                                       
CONECT    9   10   48   49   50                                       
CONECT   10    6    6   11    9                                       
CONECT   11   29   29   10   51                                       
CONECT   12   30   32   32   29                                       
CONECT   13   14   14    5   30                                       
CONECT   14   15   13   13   52                                       
CONECT   15    1    1   14   53                                       
CONECT   16   17    4    1   54                                       
CONECT   17    2   16   55   56                                       
CONECT   18   31    4   57   58                                       
CONECT   19    1   28    5    5                                       
CONECT   20    7    7    8   59                                       
CONECT   21   38   22    8    8                                       
CONECT   22   34   27   27   21                                       
CONECT   23   25   24   37   26                                       
CONECT   24   23   60   61   62                                       
CONECT   25   23   63   64   65                                       
CONECT   26   23   66   67   68                                       
CONECT   27   22   22    7   69                                       
CONECT   28   19                                                      
CONECT   29   12   11   11                                            
CONECT   30   13   12   70                                            
CONECT   31    3    2   18                                            
CONECT   32   12   12    6                                            
CONECT   33    7    6   71                                            
CONECT   34   37   22   72                                            
CONECT   35   37   37                                                 
CONECT   36   37   37                                                 
CONECT   37   35   35   23   36                                       
CONECT   37   36   34                                                 
CONECT   38   21                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   11                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   20                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   30                                                      
CONECT   71   33                                                      
CONECT   72   34                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
