COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.042  -7.253  -3.029  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.964  -7.803  -3.790  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.020  -6.861  -3.786  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.574  -5.820  -3.028  1.00  0.00           C  
HETATM    5  O   UNL     1      -0.329  -6.033  -2.559  1.00  0.00           O  
HETATM    6  C   UNL     1       1.383  -7.717  -2.647  1.00  0.00           C  
HETATM    7  C   UNL     1       2.472  -7.299  -3.644  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.292  -4.614  -2.726  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.726  -3.422  -2.537  1.00  0.00           C  
HETATM   10  S   UNL     1      -0.049  -3.077  -2.612  1.00  0.00           S  
HETATM   11  C   UNL     1      -0.386  -1.393  -2.247  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.640  -1.101  -2.081  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.487  -2.184  -2.225  1.00  0.00           C  
HETATM   14  N   UNL     1       0.642  -0.579  -2.174  1.00  0.00           N  
HETATM   15  C   UNL     1       0.473   0.854  -1.873  1.00  0.00           C  
HETATM   16  C   UNL     1       0.496   1.109  -0.404  1.00  0.00           C  
HETATM   17  C   UNL     1       1.499   1.649  -2.671  1.00  0.00           C  
HETATM   18  N   UNL     1       1.124   2.451  -3.664  1.00  0.00           N  
HETATM   19  N   UNL     1       2.228   3.013  -4.177  1.00  0.00           N  
HETATM   20  N   UNL     1       3.230   2.517  -3.461  1.00  0.00           N  
HETATM   21  N   UNL     1       2.768   1.647  -2.500  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.228   2.174   0.131  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.207   2.412   1.505  1.00  0.00           C  
HETATM   24  C   UNL     1       0.538   1.584   2.345  1.00  0.00           C  
HETATM   25  C   UNL     1       1.262   0.518   1.810  1.00  0.00           C  
HETATM   26  C   UNL     1       1.241   0.280   0.435  1.00  0.00           C  
HETATM   27  F   UNL     1       0.559   1.812   3.664  1.00  0.00           F  
HETATM   28  O   UNL     1      -3.705  -2.153  -2.115  1.00  0.00           O  
HETATM   29  H   UNL     1      -0.942  -8.763  -4.286  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.977  -6.952  -4.282  1.00  0.00           H  
HETATM   31  H   UNL     1       1.672  -7.340  -1.644  1.00  0.00           H  
HETATM   32  H   UNL     1       1.416  -8.821  -2.545  1.00  0.00           H  
HETATM   33  H   UNL     1       2.261  -7.705  -4.639  1.00  0.00           H  
HETATM   34  H   UNL     1       3.458  -7.657  -3.334  1.00  0.00           H  
HETATM   35  H   UNL     1       2.518  -6.208  -3.730  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.379  -4.672  -2.673  1.00  0.00           H  
HETATM   37  H   UNL     1       1.575  -0.925  -2.322  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.523   1.096  -2.289  1.00  0.00           H  
HETATM   39  H   UNL     1       0.216   2.678  -4.051  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.811   2.825  -0.516  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.770   3.242   1.922  1.00  0.00           H  
HETATM   42  H   UNL     1       1.842  -0.126   2.464  1.00  0.00           H  
HETATM   43  H   UNL     1       1.807  -0.552   0.027  1.00  0.00           H  
CONECT    1    2    2    5    6                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    8    5                                       
CONECT    5    1    4                                                 
CONECT    6    1    7   31   32                                       
CONECT    7    6   33   34   35                                       
CONECT    8    4    9    9   36                                       
CONECT    9    8    8   10   13                                       
CONECT   10    9   11                                                 
CONECT   11   10   14   12   12                                       
CONECT   12   11   11   13                                            
CONECT   13    9   12   28   28                                       
CONECT   14   11   15   37                                            
CONECT   15   14   17   16   38                                       
CONECT   16   15   26   26   22                                       
CONECT   17   15   21   21   18                                       
CONECT   18   17   19   39                                            
CONECT   19   18   20   20                                            
CONECT   20   19   19   21                                            
CONECT   21   17   17   20                                            
CONECT   22   16   23   23   40                                       
CONECT   23   22   22   24   41                                       
CONECT   24   23   25   25   27                                       
CONECT   25   24   24   26   42                                       
CONECT   26   16   16   25   43                                       
CONECT   27   24                                                      
CONECT   28   13   13                                                 
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
