COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.199   2.852  -0.237  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.607   1.475  -0.693  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.982   0.549   0.212  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.378  -0.790  -0.232  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.212  -1.448  -0.972  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.009  -1.557  -0.034  1.00  0.00           C  
HETATM    7  N   UNL     1       1.146  -2.078  -0.777  1.00  0.00           N  
HETATM    8  C   UNL     1       2.357  -2.065   0.055  1.00  0.00           C  
HETATM    9  C   UNL     1       3.089  -0.750   0.117  1.00  0.00           C  
HETATM   10  C   UNL     1       4.238  -0.539   0.762  1.00  0.00           C  
HETATM   11  C   UNL     1       4.724   0.755   0.679  1.00  0.00           C  
HETATM   12  C   UNL     1       3.970   1.594  -0.032  1.00  0.00           C  
HETATM   13  S   UNL     1       2.563   0.741  -0.654  1.00  0.00           S  
HETATM   14  C   UNL     1       6.007   1.182   1.343  1.00  0.00           C  
HETATM   15  C   UNL     1       7.175   0.975   0.377  1.00  0.00           C  
HETATM   16  C   UNL     1       7.266  -0.504  -0.004  1.00  0.00           C  
HETATM   17  C   UNL     1       6.949   1.814  -0.883  1.00  0.00           C  
HETATM   18  C   UNL     1       8.478   1.409   1.051  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.597   1.200  -1.874  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.582  -0.681  -1.170  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.766  -0.146  -0.407  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.987   1.216  -0.341  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.076   1.709   0.359  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.943   0.835   0.993  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.720  -0.529   0.926  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.635  -1.020   0.220  1.00  0.00           C  
HETATM   27  F   UNL     1      -6.291   3.041   0.424  1.00  0.00           F  
HETATM   28  F   UNL     1      -7.565  -1.383   1.544  1.00  0.00           F  
HETATM   29  O   UNL     1      -1.599  -2.754  -1.405  1.00  0.00           O  
HETATM   30  C   UNL     1       3.196  -3.344   0.100  1.00  0.00           C  
HETATM   31  C   UNL     1       2.358  -2.935   1.314  1.00  0.00           C  
HETATM   32  H   UNL     1      -1.270   2.911   0.849  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.171   3.047  -0.544  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.860   3.594  -0.685  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.990   0.769   1.156  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.646  -1.395   0.634  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.944  -0.843  -1.838  1.00  0.00           H  
HETATM   38  H   UNL     1       0.231  -0.572   0.366  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.248  -2.234   0.787  1.00  0.00           H  
HETATM   40  H   UNL     1       0.961  -3.004  -1.131  1.00  0.00           H  
HETATM   41  H   UNL     1       4.750  -1.318   1.307  1.00  0.00           H  
HETATM   42  H   UNL     1       4.191   2.638  -0.203  1.00  0.00           H  
HETATM   43  H   UNL     1       5.943   2.236   1.615  1.00  0.00           H  
HETATM   44  H   UNL     1       6.169   0.585   2.241  1.00  0.00           H  
HETATM   45  H   UNL     1       6.338  -0.813  -0.485  1.00  0.00           H  
HETATM   46  H   UNL     1       8.098  -0.651  -0.693  1.00  0.00           H  
HETATM   47  H   UNL     1       7.427  -1.101   0.893  1.00  0.00           H  
HETATM   48  H   UNL     1       6.884   2.867  -0.612  1.00  0.00           H  
HETATM   49  H   UNL     1       7.781   1.666  -1.572  1.00  0.00           H  
HETATM   50  H   UNL     1       6.021   1.504  -1.364  1.00  0.00           H  
HETATM   51  H   UNL     1       8.639   0.812   1.948  1.00  0.00           H  
HETATM   52  H   UNL     1       9.310   1.262   0.362  1.00  0.00           H  
HETATM   53  H   UNL     1       8.414   2.463   1.322  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.342  -0.004  -1.991  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.821  -1.666  -1.570  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.311   1.898  -0.835  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.792   1.218   1.540  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.461  -2.084   0.167  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.851  -3.348  -0.685  1.00  0.00           H  
HETATM   60  H   UNL     1       2.850  -4.194  -0.487  1.00  0.00           H  
HETATM   61  H   UNL     1       4.278  -3.234   0.176  1.00  0.00           H  
HETATM   62  H   UNL     1       2.889  -2.556   2.187  1.00  0.00           H  
HETATM   63  H   UNL     1       1.461  -3.517   1.524  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1   19   19    3                                       
CONECT    3    2    4   35                                            
CONECT    4    3   20    5   36                                       
CONECT    5    4    6   29   37                                       
CONECT    6    5    7   38   39                                       
CONECT    7    6    8   40                                            
CONECT    8    7    9   30   31                                       
CONECT    9    8   13   10   10                                       
CONECT   10    9    9   11   41                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   42                                       
CONECT   13    9   12                                                 
CONECT   14   11   15   43   44                                       
CONECT   15   14   16   18   17                                       
CONECT   16   15   45   46   47                                       
CONECT   17   15   48   49   50                                       
CONECT   18   15   51   52   53                                       
CONECT   19    2    2                                                 
CONECT   20    4   21   54   55                                       
CONECT   21   20   26   26   22                                       
CONECT   22   21   23   23   56                                       
CONECT   23   22   22   24   27                                       
CONECT   24   23   25   25   57                                       
CONECT   25   24   24   28   26                                       
CONECT   26   21   21   25   58                                       
CONECT   27   23                                                      
CONECT   28   25                                                      
CONECT   29    5   59                                                 
CONECT   30    8   31   60   61                                       
CONECT   31    8   30   62   63                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   22                                                      
CONECT   57   24                                                      
CONECT   58   26                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
