COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.474   3.964  -1.052  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.730   2.866  -0.253  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.648   2.156   0.273  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.795   0.333   1.595  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.777  -2.823   2.197  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.344   0.655   1.377  1.00  0.00           C  
HETATM    7  C   UNL     1       0.570   1.628   0.672  1.00  0.00           C  
HETATM    8  C   UNL     1       2.324   1.373   2.430  1.00  0.00           C  
HETATM    9  C   UNL     1       4.417   0.499   1.510  1.00  0.00           C  
HETATM   10  C   UNL     1       0.475   5.730  -2.316  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.899   5.407  -2.092  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.158   4.329  -1.308  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.605   1.028   1.096  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.195  -0.742   0.618  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.269  -1.515   0.870  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.769  -2.596   0.008  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.181  -2.028  -1.352  1.00  0.00           C  
HETATM   18  F   UNL     1      -4.071  -1.440  -1.968  1.00  0.00           F  
HETATM   19  F   UNL     1      -5.670  -3.060  -2.159  1.00  0.00           F  
HETATM   20  F   UNL     1      -6.179  -1.065  -1.171  1.00  0.00           F  
HETATM   21  C   UNL     1      -5.995  -3.215   0.712  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.138  -1.419   2.057  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.550  -0.912  -0.395  1.00  0.00           O  
HETATM   24  O   UNL     1      -0.005  -0.285   2.066  1.00  0.00           O  
HETATM   25  C   UNL     1      -0.363   2.584  -0.030  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.156   3.636  -0.794  1.00  0.00           N  
HETATM   27  C   UNL     1       1.434   2.374   1.685  1.00  0.00           C  
HETATM   28  N   UNL     1       3.073   0.582   1.444  1.00  0.00           N  
HETATM   29  O   UNL     1       5.028   1.166   2.322  1.00  0.00           O  
HETATM   30  C   UNL     1       5.147  -0.401   0.594  1.00  0.00           C  
HETATM   31  C   UNL     1       6.342   0.028  -0.004  1.00  0.00           C  
HETATM   32  C   UNL     1       7.027  -0.789  -0.850  1.00  0.00           C  
HETATM   33  C   UNL     1       6.546  -2.067  -1.135  1.00  0.00           C  
HETATM   34  N   UNL     1       6.996  -3.091  -1.923  1.00  0.00           N  
HETATM   35  N   UNL     1       6.105  -4.165  -1.836  1.00  0.00           N  
HETATM   36  C   UNL     1       5.122  -3.867  -1.035  1.00  0.00           C  
HETATM   37  C   UNL     1       5.347  -2.511  -0.541  1.00  0.00           C  
HETATM   38  C   UNL     1       4.651  -1.672   0.331  1.00  0.00           C  
HETATM   39  C   UNL     1       2.332  -0.118   0.386  1.00  0.00           C  
HETATM   40  C   UNL     1       1.442   0.895  -0.343  1.00  0.00           C  
HETATM   41  H   UNL     1      -3.289   4.531  -1.478  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.744   2.564  -0.040  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.573  -0.118   2.562  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.612   1.046   1.706  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.726  -2.769   2.730  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.094  -3.516   2.689  1.00  0.00           H  
HETATM   47  H   UNL     1       3.021   1.911   3.073  1.00  0.00           H  
HETATM   48  H   UNL     1       1.705   0.711   3.036  1.00  0.00           H  
HETATM   49  H   UNL     1       0.541   6.610  -2.957  1.00  0.00           H  
HETATM   50  H   UNL     1       0.960   5.938  -1.363  1.00  0.00           H  
HETATM   51  H   UNL     1       0.971   4.890  -2.801  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.995  -3.353  -0.124  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.999  -4.299   0.596  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.918  -2.781   0.329  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.910  -0.664   1.902  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.547  -1.181   2.942  1.00  0.00           H  
HETATM   57  H   UNL     1       2.060   3.099   1.164  1.00  0.00           H  
HETATM   58  H   UNL     1       0.793   2.892   2.398  1.00  0.00           H  
HETATM   59  H   UNL     1       6.722   1.016   0.210  1.00  0.00           H  
HETATM   60  H   UNL     1       7.946  -0.446  -1.304  1.00  0.00           H  
HETATM   61  H   UNL     1       7.805  -3.074  -2.458  1.00  0.00           H  
HETATM   62  H   UNL     1       4.291  -4.508  -0.782  1.00  0.00           H  
HETATM   63  H   UNL     1       3.735  -2.006   0.794  1.00  0.00           H  
HETATM   64  H   UNL     1       3.033  -0.563  -0.319  1.00  0.00           H  
HETATM   65  H   UNL     1       1.713  -0.899   0.829  1.00  0.00           H  
HETATM   66  H   UNL     1       0.807   0.372  -1.058  1.00  0.00           H  
HETATM   67  H   UNL     1       2.069   1.615  -0.871  1.00  0.00           H  
CONECT    1    2    2   12   41                                       
CONECT    2    1    1    3   42                                       
CONECT    3    2   13   25   25                                       
CONECT    4   14   13   43   44                                       
CONECT    5   21   22   45   46                                       
CONECT    6   13   24   24    7                                       
CONECT    7   27   25    6   40                                       
CONECT    8   27   28   47   48                                       
CONECT    9   30   28   29   29                                       
CONECT   10   11   49   50   51                                       
CONECT   11   12   10                                                 
CONECT   12    1   11   26   26                                       
CONECT   13    4    3    6                                            
CONECT   14   23   23   15    4                                       
CONECT   15   16   14   22                                            
CONECT   16   17   21   15   52                                       
CONECT   17   19   18   20   16                                       
CONECT   18   17                                                      
CONECT   19   17                                                      
CONECT   20   17                                                      
CONECT   21   16    5   53   54                                       
CONECT   22   15    5   55   56                                       
CONECT   23   14   14                                                 
CONECT   24    6    6                                                 
CONECT   25    3    3   26    7                                       
CONECT   26   12   12   25                                            
CONECT   27    8    7   57   58                                       
CONECT   28    8    9   39                                            
CONECT   29    9    9                                                 
CONECT   30   38   38   31    9                                       
CONECT   31   32   32   30   59                                       
CONECT   32   33   31   31   60                                       
CONECT   33   34   37   37   32                                       
CONECT   34   35   33   61                                            
CONECT   35   36   36   34                                            
CONECT   36   35   35   37   62                                       
CONECT   37   36   33   33   38                                       
CONECT   38   37   30   30   63                                       
CONECT   39   28   40   64   65                                       
CONECT   40    7   39   66   67                                       
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   16                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   34                                                      
CONECT   62   36                                                      
CONECT   63   38                                                      
CONECT   64   39                                                      
CONECT   65   39                                                      
CONECT   66   40                                                      
CONECT   67   40                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
