COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.081  -3.141   0.640  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.579  -3.389   0.839  1.00  0.00           C  
HETATM    3  O   UNL     1      -8.294  -2.897  -0.298  1.00  0.00           O  
HETATM    4  C   UNL     1      -8.095  -1.502  -0.543  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.603  -1.234  -0.755  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.853  -1.705   0.419  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.420  -1.415   0.279  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.202   0.099   0.300  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.709   0.401   0.155  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.505   1.815   0.175  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.224   2.256   0.056  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.961   3.633   0.069  1.00  0.00           C  
HETATM   13  C   UNL     1       0.328   4.104  -0.051  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.988   4.512   0.199  1.00  0.00           O  
HETATM   15  C   UNL     1      -1.656   5.902   0.205  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.207   1.352  -0.069  1.00  0.00           C  
HETATM   17  C   UNL     1       1.112   1.805  -0.192  1.00  0.00           C  
HETATM   18  C   UNL     1       1.385   3.195  -0.185  1.00  0.00           C  
HETATM   19  N   UNL     1       2.658   3.603  -0.305  1.00  0.00           N  
HETATM   20  C   UNL     1       3.627   2.728  -0.431  1.00  0.00           C  
HETATM   21  N   UNL     1       3.420   1.421  -0.447  1.00  0.00           N  
HETATM   22  C   UNL     1       2.201   0.911  -0.324  1.00  0.00           C  
HETATM   23  N   UNL     1       1.999  -0.455  -0.336  1.00  0.00           N  
HETATM   24  C   UNL     1       3.096  -1.323  -0.345  1.00  0.00           C  
HETATM   25  C   UNL     1       4.257  -0.985   0.337  1.00  0.00           C  
HETATM   26  C   UNL     1       5.339  -1.845   0.326  1.00  0.00           C  
HETATM   27 CL   UNL     1       6.791  -1.423   1.179  1.00  0.00          Cl  
HETATM   28  C   UNL     1       5.265  -3.044  -0.365  1.00  0.00           C  
HETATM   29  F   UNL     1       6.323  -3.884  -0.374  1.00  0.00           F  
HETATM   30  C   UNL     1       4.108  -3.383  -1.045  1.00  0.00           C  
HETATM   31  C   UNL     1       3.023  -2.528  -1.033  1.00  0.00           C  
HETATM   32  H   UNL     1      -5.538  -3.462   1.529  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.731  -3.703  -0.225  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.759  -4.459   0.947  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.918  -2.870   1.735  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.648  -1.207  -1.434  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.449  -0.928   0.313  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.260  -1.766  -1.643  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.440  -0.164  -0.886  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.875  -1.872   1.105  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.057  -1.822  -0.665  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.747   0.556  -0.525  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.565   0.505   1.245  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.164  -0.056   0.981  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.346  -0.005  -0.789  1.00  0.00           H  
HETATM   46  H   UNL     1       0.522   5.166  -0.040  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.983   6.111   1.037  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.165   6.162  -0.733  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.565   6.493   0.315  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.420   0.293  -0.073  1.00  0.00           H  
HETATM   51  H   UNL     1       4.640   3.090  -0.525  1.00  0.00           H  
HETATM   52  H   UNL     1       4.314  -0.051   0.875  1.00  0.00           H  
HETATM   53  H   UNL     1       4.052  -4.318  -1.583  1.00  0.00           H  
HETATM   54  H   UNL     1       2.119  -2.795  -1.560  1.00  0.00           H  
HETATM   55  H   UNL     1       1.098  -0.812  -0.338  1.00  0.00           H  
CONECT    1    2    6   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   36   37                                       
CONECT    5    4    6   38   39                                       
CONECT    6    1    5    7                                            
CONECT    7    6    8   40   41                                       
CONECT    8    7    9   42   43                                       
CONECT    9    8   10   44   45                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   14                                       
CONECT   13   12   18   18   46                                       
CONECT   14   12   15                                                 
CONECT   15   14   47   48   49                                       
CONECT   16   11   17   17   50                                       
CONECT   17   16   16   18   22                                       
CONECT   18   13   13   17   19                                       
CONECT   19   18   20   20                                            
CONECT   20   19   19   21   51                                       
CONECT   21   20   22   22                                            
CONECT   22   17   21   21   23                                       
CONECT   23   22   24   55                                            
CONECT   24   23   25   25   31                                       
CONECT   25   24   24   26   52                                       
CONECT   26   25   27   28   28                                       
CONECT   27   26                                                      
CONECT   28   26   26   29   30                                       
CONECT   29   28                                                      
CONECT   30   28   31   31   53                                       
CONECT   31   24   30   30   54                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   20                                                      
CONECT   52   25                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   23                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
