COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -7.591  -1.085  -2.263  1.00  0.00           F  
HETATM    2  C   UNL     1      -7.062  -0.082  -1.443  1.00  0.00           C  
HETATM    3  F   UNL     1      -6.461   0.901  -2.236  1.00  0.00           F  
HETATM    4  F   UNL     1      -8.090   0.493  -0.688  1.00  0.00           F  
HETATM    5  C   UNL     1      -6.033  -0.680  -0.518  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.752  -2.032  -0.578  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.808  -2.580   0.270  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.146  -1.776   1.178  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.367   0.125   0.387  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.426  -0.424   1.238  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.704   0.452   2.229  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.450   0.998   1.596  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.299   2.169   0.990  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.065   2.447   0.492  1.00  0.00           N  
HETATM   15  S   UNL     1      -0.862   0.214   1.512  1.00  0.00           S  
HETATM   16  C   UNL     1      -0.107   1.507   0.661  1.00  0.00           C  
HETATM   17  N   UNL     1       1.164   1.570   0.255  1.00  0.00           N  
HETATM   18  C   UNL     1       1.988   0.559   0.497  1.00  0.00           C  
HETATM   19  O   UNL     1       1.587  -0.425   1.088  1.00  0.00           O  
HETATM   20  C   UNL     1       3.422   0.631   0.039  1.00  0.00           C  
HETATM   21  S   UNL     1       4.284  -0.889   0.514  1.00  0.00           S  
HETATM   22  C   UNL     1       5.889  -0.544  -0.126  1.00  0.00           C  
HETATM   23  N   UNL     1       6.851  -1.443   0.022  1.00  0.00           N  
HETATM   24  C   UNL     1       8.067  -1.215  -0.447  1.00  0.00           C  
HETATM   25  C   UNL     1       9.155  -2.243  -0.276  1.00  0.00           C  
HETATM   26  C   UNL     1       8.327  -0.019  -1.098  1.00  0.00           C  
HETATM   27  N   UNL     1       6.103   0.607  -0.748  1.00  0.00           N  
HETATM   28  C   UNL     1       7.298   0.899  -1.235  1.00  0.00           C  
HETATM   29  C   UNL     1       7.536   2.213  -1.935  1.00  0.00           C  
HETATM   30  H   UNL     1      -6.270  -2.660  -1.288  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.584   1.182   0.431  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.589  -3.636   0.223  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.409  -2.204   1.842  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.352   1.279   2.523  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.442  -0.134   3.109  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.117   2.867   0.896  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.880   3.283   0.036  1.00  0.00           H  
HETATM   38  H   UNL     1       3.453   0.742  -1.045  1.00  0.00           H  
HETATM   39  H   UNL     1       3.911   1.486   0.506  1.00  0.00           H  
HETATM   40  H   UNL     1       9.153  -2.920  -1.130  1.00  0.00           H  
HETATM   41  H   UNL     1      10.121  -1.742  -0.212  1.00  0.00           H  
HETATM   42  H   UNL     1       8.979  -2.810   0.638  1.00  0.00           H  
HETATM   43  H   UNL     1       9.311   0.193  -1.490  1.00  0.00           H  
HETATM   44  H   UNL     1       7.329   2.100  -2.999  1.00  0.00           H  
HETATM   45  H   UNL     1       6.876   2.973  -1.515  1.00  0.00           H  
HETATM   46  H   UNL     1       8.573   2.515  -1.796  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6    9    9                                       
CONECT    6    5    7    7   30                                       
CONECT    7    6    6    8   32                                       
CONECT    8    7   10   10   33                                       
CONECT    9    5    5   10   31                                       
CONECT   10    8    8    9   11                                       
CONECT   11   10   12   34   35                                       
CONECT   12   11   13   13   15                                       
CONECT   13   12   12   14   36                                       
CONECT   14   13   16   37                                            
CONECT   15   12   16                                                 
CONECT   16   14   15   17   17                                       
CONECT   17   16   16   18                                            
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   38   39                                       
CONECT   21   20   22                                                 
CONECT   22   21   23   27   27                                       
CONECT   23   22   24   24                                            
CONECT   24   23   23   25   26                                       
CONECT   25   24   40   41   42                                       
CONECT   26   24   28   28   43                                       
CONECT   27   22   22   28                                            
CONECT   28   26   26   27   29                                       
CONECT   29   28   44   45   46                                       
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   25                                                      
CONECT   41   25                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   29                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
