COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.465  -0.742  -0.255  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.676  -1.199   0.234  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.247   0.568   0.031  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.325  -2.539   0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.983  -2.924   0.278  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.152  -4.745   0.879  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.723  -0.344  -0.113  1.00  0.00           N  
HETATM    8  N   UNL     1      -0.909  -4.264   0.545  1.00  0.00           N  
HETATM    9  N   UNL     1      -0.092  -1.996  -0.068  1.00  0.00           N  
HETATM   10  O   UNL     1      -3.958  -0.788   0.377  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.053  -3.750   0.830  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.371   1.095   0.924  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.680   2.547   0.553  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.118   2.617  -0.911  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.993   2.091  -1.805  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.684   0.639  -1.434  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.426   4.069  -1.282  1.00  0.00           C  
HETATM   18  C   UNL     1       1.839  -0.171  -0.663  1.00  0.00           C  
HETATM   19  C   UNL     1       2.210  -1.395  -1.207  1.00  0.00           C  
HETATM   20  O   UNL     1      -7.288   1.819  -1.097  1.00  0.00           O  
HETATM   21 CL   UNL     1      -4.750  -3.874   1.171  1.00  0.00          Cl  
HETATM   22  N   UNL     1       0.493   0.191  -0.619  1.00  0.00           N  
HETATM   23  C   UNL     1       3.538  -1.760  -1.247  1.00  0.00           C  
HETATM   24  C   UNL     1       4.515  -0.900  -0.740  1.00  0.00           C  
HETATM   25  C   UNL     1       5.937  -1.290  -0.782  1.00  0.00           C  
HETATM   26  O   UNL     1       6.788  -0.459  -1.031  1.00  0.00           O  
HETATM   27  N   UNL     1       6.293  -2.568  -0.543  1.00  0.00           N  
HETATM   28  C   UNL     1       5.264  -3.603  -0.415  1.00  0.00           C  
HETATM   29  C   UNL     1       7.708  -2.922  -0.412  1.00  0.00           C  
HETATM   30  C   UNL     1       4.142   0.332  -0.192  1.00  0.00           C  
HETATM   31  C   UNL     1       2.810   0.693  -0.155  1.00  0.00           C  
HETATM   32  O   UNL     1       2.445   1.890   0.377  1.00  0.00           O  
HETATM   33  C   UNL     1       3.497   2.776   0.764  1.00  0.00           C  
HETATM   34  C   UNL     1       3.967   2.424   2.177  1.00  0.00           C  
HETATM   35  C   UNL     1       2.984   4.217   0.742  1.00  0.00           C  
HETATM   36  F   UNL     1       2.554   4.540  -0.550  1.00  0.00           F  
HETATM   37  F   UNL     1       1.914   4.345   1.635  1.00  0.00           F  
HETATM   38  F   UNL     1       4.014   5.085   1.121  1.00  0.00           F  
HETATM   39  H   UNL     1      -3.354   1.178   0.173  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.372  -5.771   1.135  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.098  -4.794   0.509  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.264   0.486   0.782  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.060   1.045   1.968  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.481   2.922   1.190  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.787   3.156   0.696  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.305   2.141  -2.848  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.100   2.700  -1.663  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.883   0.263  -2.071  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.577   0.030  -1.576  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.561   4.693  -1.059  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.655   4.131  -2.346  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.283   4.417  -0.705  1.00  0.00           H  
HETATM   53  H   UNL     1       1.456  -2.062  -1.600  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.622   1.816  -2.005  1.00  0.00           H  
HETATM   55  H   UNL     1       0.227   1.097  -0.844  1.00  0.00           H  
HETATM   56  H   UNL     1       3.824  -2.712  -1.670  1.00  0.00           H  
HETATM   57  H   UNL     1       5.029  -4.005  -1.401  1.00  0.00           H  
HETATM   58  H   UNL     1       5.631  -4.404   0.226  1.00  0.00           H  
HETATM   59  H   UNL     1       4.365  -3.170   0.024  1.00  0.00           H  
HETATM   60  H   UNL     1       8.319  -2.028  -0.536  1.00  0.00           H  
HETATM   61  H   UNL     1       7.886  -3.350   0.575  1.00  0.00           H  
HETATM   62  H   UNL     1       7.972  -3.652  -1.177  1.00  0.00           H  
HETATM   63  H   UNL     1       4.895   0.999   0.201  1.00  0.00           H  
HETATM   64  H   UNL     1       4.330   2.677   0.068  1.00  0.00           H  
HETATM   65  H   UNL     1       3.134   2.523   2.872  1.00  0.00           H  
HETATM   66  H   UNL     1       4.333   1.397   2.192  1.00  0.00           H  
HETATM   67  H   UNL     1       4.769   3.099   2.472  1.00  0.00           H  
CONECT    1    9    9    7   22                                       
CONECT    2    4   10    7    7                                       
CONECT    3   10   16   12   39                                       
CONECT    4   11    5    5    2                                       
CONECT    5    8    4    4    9                                       
CONECT    6    8   11   11   40                                       
CONECT    7    2    2    1                                            
CONECT    8    6    5   41                                            
CONECT    9    5    1    1                                            
CONECT   10    2    3                                                 
CONECT   11    6    6   21    4                                       
CONECT   12    3   13   42   43                                       
CONECT   13   12   14   44   45                                       
CONECT   14   20   15   13   17                                       
CONECT   15   16   14   46   47                                       
CONECT   16    3   15   48   49                                       
CONECT   17   14   50   51   52                                       
CONECT   18   22   19   19   31                                       
CONECT   19   18   18   23   53                                       
CONECT   20   14   54                                                 
CONECT   21   11                                                      
CONECT   22    1   18   55                                            
CONECT   23   19   24   24   56                                       
CONECT   24   23   23   30   25                                       
CONECT   25   24   27   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   28   25   29                                            
CONECT   28   27   57   58   59                                       
CONECT   29   27   60   61   62                                       
CONECT   30   31   31   24   63                                       
CONECT   31   18   32   30   30                                       
CONECT   32   31   33                                                 
CONECT   33   32   34   35   64                                       
CONECT   34   33   65   66   67                                       
CONECT   35   36   33   37   38                                       
CONECT   36   35                                                      
CONECT   37   35                                                      
CONECT   38   35                                                      
CONECT   39    3                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
