COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.353   4.319  -0.395  1.00  0.00           C  
HETATM    2  C   UNL     1       4.742   2.024  -0.259  1.00  0.00           C  
HETATM    3  C   UNL     1       6.020   1.568  -0.197  1.00  0.00           C  
HETATM    4  O   UNL     1      -8.528  -1.472  -1.852  1.00  0.00           O  
HETATM    5  C   UNL     1      -0.225   0.503  -1.178  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.598   0.459  -1.326  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.343  -0.473  -0.620  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.456   0.079   0.185  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.878   0.798   1.216  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.684   1.395   2.177  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.619   0.624   1.168  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.021   0.537   1.139  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.637  -0.157   0.138  1.00  0.00           C  
HETATM   14  C   UNL     1     -10.700   0.424   1.165  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.525  -0.719  -0.866  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.866  -0.013   0.152  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.709  -1.364   0.238  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.335  -1.321   0.387  1.00  0.00           C  
HETATM   19  C   UNL     1       8.115  -0.508  -0.925  1.00  0.00           C  
HETATM   20  C   UNL     1       8.206  -2.465   1.034  1.00  0.00           C  
HETATM   21  F   UNL     1      10.319  -3.155   0.214  1.00  0.00           F  
HETATM   22  C   UNL     1       9.254  -2.327   0.140  1.00  0.00           C  
HETATM   23  C   UNL     1       9.207  -1.348  -0.839  1.00  0.00           C  
HETATM   24  C   UNL     1       7.117  -1.619   0.959  1.00  0.00           C  
HETATM   25  C   UNL     1       5.979  -1.766   1.937  1.00  0.00           C  
HETATM   26  C   UNL     1       7.065  -0.641  -0.025  1.00  0.00           C  
HETATM   27  N   UNL     1       5.956   0.211  -0.110  1.00  0.00           N  
HETATM   28  N   UNL     1       4.731  -0.175  -0.116  1.00  0.00           N  
HETATM   29  C   UNL     1       3.924   0.867  -0.198  1.00  0.00           C  
HETATM   30  O   UNL     1       4.334   3.318  -0.355  1.00  0.00           O  
HETATM   31  C   UNL     1       4.706   5.701  -0.502  1.00  0.00           C  
HETATM   32  C   UNL     1       2.451   0.834  -0.231  1.00  0.00           C  
HETATM   33  O   UNL     1       1.821   1.871  -0.309  1.00  0.00           O  
HETATM   34  N   UNL     1       1.802  -0.346  -0.175  1.00  0.00           N  
HETATM   35  C   UNL     1       0.410  -0.387  -0.321  1.00  0.00           C  
HETATM   36  F   UNL     1      -2.435  -2.272   0.927  1.00  0.00           F  
HETATM   37  O   UNL     1      -3.694  -0.515  -0.766  1.00  0.00           O  
HETATM   38  N   UNL     1      -5.992   1.299   2.139  1.00  0.00           N  
HETATM   39  C   UNL     1      -7.889  -0.787  -0.867  1.00  0.00           C  
HETATM   40  C   UNL     1      -7.710  -2.092  -2.847  1.00  0.00           C  
HETATM   41  O   UNL     1      -9.993  -0.238   0.115  1.00  0.00           O  
HETATM   42  H   UNL     1       5.949   4.267   0.516  1.00  0.00           H  
HETATM   43  H   UNL     1       5.994   4.150  -1.260  1.00  0.00           H  
HETATM   44  H   UNL     1       6.917   2.168  -0.214  1.00  0.00           H  
HETATM   45  H   UNL     1       0.355   1.226  -1.731  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.091   1.152  -1.992  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.803   0.894   1.274  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.221   1.954   2.977  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.609   1.018   1.907  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.398   0.008   2.126  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.471   1.490   1.142  1.00  0.00           H  
HETATM   52  H   UNL     1     -11.772   0.281   1.028  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.957  -1.208  -1.643  1.00  0.00           H  
HETATM   54  H   UNL     1       0.158  -2.013   1.053  1.00  0.00           H  
HETATM   55  H   UNL     1       8.078   0.256  -1.688  1.00  0.00           H  
HETATM   56  H   UNL     1       8.244  -3.229   1.796  1.00  0.00           H  
HETATM   57  H   UNL     1      10.025  -1.242  -1.536  1.00  0.00           H  
HETATM   58  H   UNL     1       5.288  -2.529   1.579  1.00  0.00           H  
HETATM   59  H   UNL     1       6.373  -2.060   2.910  1.00  0.00           H  
HETATM   60  H   UNL     1       5.455  -0.815   2.029  1.00  0.00           H  
HETATM   61  H   UNL     1       4.109   5.754  -1.412  1.00  0.00           H  
HETATM   62  H   UNL     1       4.064   5.870   0.363  1.00  0.00           H  
HETATM   63  H   UNL     1       5.483   6.465  -0.533  1.00  0.00           H  
HETATM   64  H   UNL     1       2.299  -1.167  -0.034  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.344  -2.604  -3.571  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.117  -1.332  -3.355  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.045  -2.814  -2.372  1.00  0.00           H  
CONECT    1   30   31   42   43                                       
CONECT    2   29    3    3   30                                       
CONECT    3   27    2    2   44                                       
CONECT    4   40   39                                                 
CONECT    5    6    6   35   45                                       
CONECT    6    7    5    5   46                                       
CONECT    7   37   17   17    6                                       
CONECT    8   16   37    9    9                                       
CONECT    9    8    8   10   47                                       
CONECT   10   38   38    9   48                                       
CONECT   11   12   12   16   38                                       
CONECT   12   13   11   11   49                                       
CONECT   13   41   39   39   12                                       
CONECT   14   41   50   51   52                                       
CONECT   15   39   16   16   53                                       
CONECT   16   15   15   11    8                                       
CONECT   17   36    7    7   18                                       
CONECT   18   17   35   35   54                                       
CONECT   19   26   23   23   55                                       
CONECT   20   24   22   22   56                                       
CONECT   21   22                                                      
CONECT   22   20   20   23   21                                       
CONECT   23   19   19   22   57                                       
CONECT   24   25   26   26   20                                       
CONECT   25   24   58   59   60                                       
CONECT   26   27   24   24   19                                       
CONECT   27   28   26    3                                            
CONECT   28   29   29   27                                            
CONECT   29   32   28   28    2                                       
CONECT   30    2    1                                                 
CONECT   31    1   61   62   63                                       
CONECT   32   34   33   33   29                                       
CONECT   33   32   32                                                 
CONECT   34   35   32   64                                            
CONECT   35   18   18    5   34                                       
CONECT   36   17                                                      
CONECT   37    8    7                                                 
CONECT   38   11   10   10                                            
CONECT   39    4   13   13   15                                       
CONECT   40    4   65   66   67                                       
CONECT   41   14   13                                                 
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   34                                                      
CONECT   65   40                                                      
CONECT   66   40                                                      
CONECT   67   40                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
