COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       2.638   3.266   0.142  1.00  0.00           F  
HETATM    2  C   UNL     1       1.298   3.329  -0.021  1.00  0.00           C  
HETATM    3  C   UNL     1       0.548   2.155  -0.130  1.00  0.00           C  
HETATM    4  C   UNL     1       0.887   0.725  -0.112  1.00  0.00           C  
HETATM    5  C   UNL     1       2.238   0.152   0.044  1.00  0.00           C  
HETATM    6  C   UNL     1       3.134   0.422  -0.877  1.00  0.00           C  
HETATM    7  C   UNL     1       4.547  -0.084  -0.842  1.00  0.00           C  
HETATM    8  C   UNL     1       4.662  -1.257   0.133  1.00  0.00           C  
HETATM    9  C   UNL     1       3.936  -2.476  -0.439  1.00  0.00           C  
HETATM   10  C   UNL     1       6.115  -1.591   0.354  1.00  0.00           C  
HETATM   11  O   UNL     1       6.588  -1.528   1.464  1.00  0.00           O  
HETATM   12  O   UNL     1       6.884  -1.958  -0.683  1.00  0.00           O  
HETATM   13  C   UNL     1       4.016  -0.849   1.463  1.00  0.00           C  
HETATM   14  C   UNL     1       2.510  -0.701   1.249  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.228   0.050  -0.258  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.307   0.932  -0.375  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.845   2.228  -0.299  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.465   3.472  -0.355  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.713   4.620  -0.245  1.00  0.00           C  
HETATM   20  C   UNL     1       0.662   4.551  -0.073  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.595   0.571  -0.539  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.444   1.419  -0.730  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.975  -0.855  -0.485  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.421  -1.418   0.713  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.515  -0.571   1.956  1.00  0.00           C  
HETATM   26  F   UNL     1      -2.250  -0.064   2.272  1.00  0.00           F  
HETATM   27  F   UNL     1      -4.400   0.489   1.732  1.00  0.00           F  
HETATM   28  F   UNL     1      -3.983  -1.352   3.018  1.00  0.00           F  
HETATM   29  C   UNL     1      -3.774  -2.750   0.756  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.689  -3.530  -0.384  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.249  -2.980  -1.575  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.896  -1.646  -1.634  1.00  0.00           C  
HETATM   33 CL   UNL     1      -2.350  -0.956  -3.131  1.00  0.00          Cl  
HETATM   34  H   UNL     1       2.837   1.044  -1.708  1.00  0.00           H  
HETATM   35  H   UNL     1       4.837  -0.414  -1.840  1.00  0.00           H  
HETATM   36  H   UNL     1       5.211   0.719  -0.523  1.00  0.00           H  
HETATM   37  H   UNL     1       4.386  -2.753  -1.393  1.00  0.00           H  
HETATM   38  H   UNL     1       4.020  -3.310   0.258  1.00  0.00           H  
HETATM   39  H   UNL     1       2.884  -2.234  -0.591  1.00  0.00           H  
HETATM   40  H   UNL     1       7.810  -2.163  -0.493  1.00  0.00           H  
HETATM   41  H   UNL     1       4.206  -1.617   2.213  1.00  0.00           H  
HETATM   42  H   UNL     1       4.433   0.101   1.797  1.00  0.00           H  
HETATM   43  H   UNL     1       2.062  -0.238   2.128  1.00  0.00           H  
HETATM   44  H   UNL     1       2.071  -1.688   1.100  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.535   3.536  -0.484  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.199   5.584  -0.290  1.00  0.00           H  
HETATM   47  H   UNL     1       1.239   5.460   0.011  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.119  -3.186   1.682  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.967  -4.573  -0.344  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.184  -3.595  -2.461  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2   20   20    3    1                                       
CONECT    3   17   17    2    4                                       
CONECT    4    3   15   15    5                                       
CONECT    5    4    6    6   14                                       
CONECT    6    5    5    7   34                                       
CONECT    7    6    8   35   36                                       
CONECT    8    7   13    9   10                                       
CONECT    9    8   37   38   39                                       
CONECT   10    8   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   40                                                 
CONECT   13   14    8   41   42                                       
CONECT   14    5   13   43   44                                       
CONECT   15   16    4    4                                            
CONECT   16   17   21   15                                            
CONECT   17   18   16    3    3                                       
CONECT   18   19   19   17   45                                       
CONECT   19   18   18   20   46                                       
CONECT   20   19    2    2   47                                       
CONECT   21   22   22   16   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   32   32   24                                       
CONECT   24   23   25   29   29                                       
CONECT   25   27   24   28   26                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   24   24   30   48                                       
CONECT   30   31   31   29   49                                       
CONECT   31   32   30   30   50                                       
CONECT   32   33   23   23   31                                       
CONECT   33   32                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
CONECT   50   31                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
