COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.736   0.102   1.091  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.770   0.551   0.091  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.882  -0.109  -1.118  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.521   0.914   0.938  1.00  0.00           N  
HETATM    5  C   UNL     1      -6.837   0.312  -2.031  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.647   1.385  -1.691  1.00  0.00           C  
HETATM    7  N   UNL     1      -6.561   1.565   0.382  1.00  0.00           N  
HETATM    8  C   UNL     1      -7.477   1.995  -0.463  1.00  0.00           C  
HETATM    9  C   UNL     1       0.428   2.115   0.445  1.00  0.00           C  
HETATM   10  C   UNL     1       0.349   3.499   0.490  1.00  0.00           C  
HETATM   11  C   UNL     1       1.493   4.262   0.347  1.00  0.00           C  
HETATM   12  N   UNL     1       1.752   0.100   0.211  1.00  0.00           N  
HETATM   13  C   UNL     1       2.718   3.649   0.157  1.00  0.00           C  
HETATM   14  C   UNL     1       2.806   2.270   0.110  1.00  0.00           C  
HETATM   15  C   UNL     1       1.665   1.497   0.259  1.00  0.00           C  
HETATM   16  N   UNL     1       0.274  -7.568   0.957  1.00  0.00           N  
HETATM   17  F   UNL     1       3.623   5.842   0.082  1.00  0.00           F  
HETATM   18  C   UNL     1       3.961   4.487   0.001  1.00  0.00           C  
HETATM   19  F   UNL     1       4.868   4.171   1.018  1.00  0.00           F  
HETATM   20  F   UNL     1       4.546   4.226  -1.243  1.00  0.00           F  
HETATM   21  C   UNL     1       2.646  -0.492  -0.605  1.00  0.00           C  
HETATM   22  O   UNL     1       3.432   0.186  -1.241  1.00  0.00           O  
HETATM   23  C   UNL     1       2.671  -1.953  -0.729  1.00  0.00           C  
HETATM   24  O   UNL     1       1.858  -2.816  -0.084  1.00  0.00           O  
HETATM   25  C   UNL     1       2.170  -4.074  -0.442  1.00  0.00           C  
HETATM   26  C   UNL     1       1.505  -5.298   0.049  1.00  0.00           C  
HETATM   27  C   UNL     1       0.451  -5.227   0.968  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.140  -6.396   1.399  1.00  0.00           C  
HETATM   29  C   UNL     1       1.263  -7.681   0.092  1.00  0.00           C  
HETATM   30  C   UNL     1       1.912  -6.564  -0.392  1.00  0.00           C  
HETATM   31  C   UNL     1       3.202  -4.031  -1.334  1.00  0.00           C  
HETATM   32  C   UNL     1       3.523  -2.683  -1.527  1.00  0.00           C  
HETATM   33  N   UNL     1      -0.728   1.341   0.590  1.00  0.00           N  
HETATM   34  C   UNL     1      -1.370   1.592   1.889  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.667   1.585  -0.513  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.880   0.664  -0.360  1.00  0.00           C  
HETATM   37  C   UNL     1      -2.582   0.671   2.042  1.00  0.00           C  
HETATM   38  H   UNL     1      -5.129   0.223   2.100  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.495  -0.947   0.918  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.234  -0.941  -1.350  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.948  -0.184  -2.984  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.401   1.740  -2.378  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.106   2.829  -0.190  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.606   3.981   0.638  1.00  0.00           H  
HETATM   45  H   UNL     1       1.430   5.339   0.382  1.00  0.00           H  
HETATM   46  H   UNL     1       1.169  -0.441   0.766  1.00  0.00           H  
HETATM   47  H   UNL     1       3.765   1.795  -0.038  1.00  0.00           H  
HETATM   48  H   UNL     1       0.107  -4.270   1.334  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.955  -6.351   2.108  1.00  0.00           H  
HETATM   50  H   UNL     1       1.569  -8.661  -0.243  1.00  0.00           H  
HETATM   51  H   UNL     1       2.720  -6.664  -1.101  1.00  0.00           H  
HETATM   52  H   UNL     1       3.678  -4.878  -1.805  1.00  0.00           H  
HETATM   53  H   UNL     1       4.293  -2.290  -2.175  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.658   1.393   2.690  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.694   2.632   1.939  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.995   2.624  -0.490  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.173   1.380  -1.463  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.556  -0.376  -0.411  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.591   0.863  -1.162  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.077   0.876   2.991  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.255  -0.368   2.018  1.00  0.00           H  
CONECT    1    4    2   38   39                                       
CONECT    2    1    7    7    3                                       
CONECT    3    2    5    5   40                                       
CONECT    4   36    1   37                                            
CONECT    5    3    3    6   41                                       
CONECT    6    8    8    5   42                                       
CONECT    7    2    2    8                                            
CONECT    8    7    6    6   43                                       
CONECT    9   10   10   15   33                                       
CONECT   10   11    9    9   44                                       
CONECT   11   13   13   10   45                                       
CONECT   12   15   21   46                                            
CONECT   13   18   11   11   14                                       
CONECT   14   13   15   15   47                                       
CONECT   15   14   14    9   12                                       
CONECT   16   28   28   29                                            
CONECT   17   18                                                      
CONECT   18   20   17   13   19                                       
CONECT   19   18                                                      
CONECT   20   18                                                      
CONECT   21   22   22   12   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   32   32   24                                       
CONECT   24   23   25                                                 
CONECT   25   31   31   24   26                                       
CONECT   26   25   27   27   30                                       
CONECT   27   26   26   28   48                                       
CONECT   28   27   16   16   49                                       
CONECT   29   30   30   16   50                                       
CONECT   30   26   29   29   51                                       
CONECT   31   32   25   25   52                                       
CONECT   32   23   23   31   53                                       
CONECT   33   35    9   34                                            
CONECT   34   33   37   54   55                                       
CONECT   35   36   33   56   57                                       
CONECT   36   35    4   58   59                                       
CONECT   37    4   34   60   61                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   34                                                      
CONECT   55   34                                                      
CONECT   56   35                                                      
CONECT   57   35                                                      
CONECT   58   36                                                      
CONECT   59   36                                                      
CONECT   60   37                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
