COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.829  -1.143  -1.032  1.00  0.00           C  
HETATM    2  C   UNL     1       1.017   4.707  -0.421  1.00  0.00           C  
HETATM    3  C   UNL     1       1.001   2.196  -0.677  1.00  0.00           C  
HETATM    4  C   UNL     1       2.461   0.076  -1.950  1.00  0.00           C  
HETATM    5  C   UNL     1       4.408  -1.308  -1.770  1.00  0.00           C  
HETATM    6  C   UNL     1       5.015  -0.355  -0.960  1.00  0.00           C  
HETATM    7  C   UNL     1     -11.211  -1.460   0.403  1.00  0.00           C  
HETATM    8  N   UNL     1      -9.769  -1.403   0.128  1.00  0.00           N  
HETATM    9  C   UNL     1      -9.392  -0.103  -0.443  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.901  -0.112  -0.788  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.990  -1.687   1.342  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.499  -1.697   0.998  1.00  0.00           C  
HETATM   13  N   UNL     1      -7.122  -0.396   0.426  1.00  0.00           N  
HETATM   14  C   UNL     1      -5.747  -0.342   0.164  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.945   0.567   0.845  1.00  0.00           C  
HETATM   16  F   UNL     1      -5.491   1.399   1.758  1.00  0.00           F  
HETATM   17  C   UNL     1      -3.588   0.620   0.586  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.185  -1.196  -0.774  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.027  -0.235  -0.354  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.652  -0.183  -0.616  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.984   1.030  -0.570  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.678   2.142  -0.380  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.076   3.321  -0.335  1.00  0.00           C  
HETATM   24  C   UNL     1       0.297   3.385  -0.478  1.00  0.00           C  
HETATM   25  N   UNL     1       2.380   2.211  -0.826  1.00  0.00           N  
HETATM   26  C   UNL     1       3.062   1.032  -1.141  1.00  0.00           C  
HETATM   27  C   UNL     1       3.135  -1.090  -2.261  1.00  0.00           C  
HETATM   28 CL   UNL     1       5.250  -2.774  -2.165  1.00  0.00          Cl  
HETATM   29  N   UNL     1       6.303  -0.576  -0.464  1.00  0.00           N  
HETATM   30  S   UNL     1       6.708  -0.046   1.051  1.00  0.00           S  
HETATM   31  C   UNL     1       5.668  -1.028   2.167  1.00  0.00           C  
HETATM   32  C   UNL     1       5.979  -2.514   1.979  1.00  0.00           C  
HETATM   33  C   UNL     1       5.953  -0.627   3.616  1.00  0.00           C  
HETATM   34  C   UNL     1       4.194  -0.772   1.848  1.00  0.00           C  
HETATM   35  O   UNL     1       8.074  -0.409   1.196  1.00  0.00           O  
HETATM   36  O   UNL     1       6.306   1.317   1.066  1.00  0.00           O  
HETATM   37  C   UNL     1       4.341   0.816  -0.646  1.00  0.00           C  
HETATM   38  N   UNL     1       0.332   1.048  -0.717  1.00  0.00           N  
HETATM   39  H   UNL     1      -3.391  -1.811  -1.760  1.00  0.00           H  
HETATM   40  H   UNL     1       1.081   5.131  -1.423  1.00  0.00           H  
HETATM   41  H   UNL     1       0.471   5.391   0.229  1.00  0.00           H  
HETATM   42  H   UNL     1       2.022   4.556  -0.026  1.00  0.00           H  
HETATM   43  H   UNL     1       1.464   0.242  -2.331  1.00  0.00           H  
HETATM   44  H   UNL     1     -11.763  -1.313  -0.525  1.00  0.00           H  
HETATM   45  H   UNL     1     -11.462  -2.433   0.825  1.00  0.00           H  
HETATM   46  H   UNL     1     -11.477  -0.676   1.112  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.973   0.079  -1.348  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.593   0.685   0.282  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.705  -0.883  -1.534  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.613   0.861  -1.185  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.186  -0.917   2.088  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.278  -2.660   1.739  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.918  -1.878   1.902  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.299  -2.485   0.272  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.964   1.326   1.114  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.808  -1.903  -1.303  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.168  -0.995  -0.830  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.650   4.222  -0.179  1.00  0.00           H  
HETATM   59  H   UNL     1       2.871   3.040  -0.711  1.00  0.00           H  
HETATM   60  H   UNL     1       2.665  -1.832  -2.890  1.00  0.00           H  
HETATM   61  H   UNL     1       6.959  -1.039  -1.008  1.00  0.00           H  
HETATM   62  H   UNL     1       7.030  -2.697   2.206  1.00  0.00           H  
HETATM   63  H   UNL     1       5.354  -3.104   2.649  1.00  0.00           H  
HETATM   64  H   UNL     1       5.776  -2.800   0.947  1.00  0.00           H  
HETATM   65  H   UNL     1       5.731   0.432   3.750  1.00  0.00           H  
HETATM   66  H   UNL     1       5.328  -1.217   4.286  1.00  0.00           H  
HETATM   67  H   UNL     1       7.003  -0.810   3.843  1.00  0.00           H  
HETATM   68  H   UNL     1       3.990  -1.058   0.816  1.00  0.00           H  
HETATM   69  H   UNL     1       3.569  -1.362   2.518  1.00  0.00           H  
HETATM   70  H   UNL     1       3.972   0.287   1.982  1.00  0.00           H  
HETATM   71  H   UNL     1       4.810   1.558  -0.017  1.00  0.00           H  
CONECT    1   18   18   19   39                                       
CONECT    2   24   40   41   42                                       
CONECT    3   24   24   25   38                                       
CONECT    4   26   26   27   43                                       
CONECT    5    6   27   27   28                                       
CONECT    6    5   29   37   37                                       
CONECT    7    8   44   45   46                                       
CONECT    8    7    9   11                                            
CONECT    9    8   10   47   48                                       
CONECT   10    9   13   49   50                                       
CONECT   11    8   12   51   52                                       
CONECT   12   11   13   53   54                                       
CONECT   13   10   12   14                                            
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16   17                                       
CONECT   16   15                                                      
CONECT   17   15   19   19   55                                       
CONECT   18    1    1   14   56                                       
CONECT   19    1   17   17   20                                       
CONECT   20   19   21   57                                            
CONECT   21   20   22   38   38                                       
CONECT   22   21   23   23                                            
CONECT   23   22   22   24   58                                       
CONECT   24    2    3    3   23                                       
CONECT   25    3   26   59                                            
CONECT   26    4    4   25   37                                       
CONECT   27    4    5    5   60                                       
CONECT   28    5                                                      
CONECT   29    6   30   61                                            
CONECT   30   29   31   35   35                                       
CONECT   30   36   36                                                 
CONECT   31   30   32   33   34                                       
CONECT   32   31   62   63   64                                       
CONECT   33   31   65   66   67                                       
CONECT   34   31   68   69   70                                       
CONECT   35   30   30                                                 
CONECT   36   30   30                                                 
CONECT   37    6    6   26   71                                       
CONECT   38    3   21   21                                            
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   20                                                      
CONECT   58   23                                                      
CONECT   59   25                                                      
CONECT   60   27                                                      
CONECT   61   29                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   37                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
