COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.865   1.826   1.121  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.448   1.399  -0.142  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.163   1.810  -0.582  1.00  0.00           C  
HETATM    4  N   UNL     1       0.575   2.569   0.215  1.00  0.00           N  
HETATM    5  N   UNL     1      -1.047   2.593   1.853  1.00  0.00           N  
HETATM    6  F   UNL     1      -4.464  -1.952   1.250  1.00  0.00           F  
HETATM    7  C   UNL     1      -4.546  -1.883  -0.145  1.00  0.00           C  
HETATM    8  F   UNL     1      -3.370  -2.391  -0.707  1.00  0.00           F  
HETATM    9  F   UNL     1      -5.638  -2.638  -0.586  1.00  0.00           F  
HETATM   10  C   UNL     1      -4.728  -0.425  -0.574  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.552   0.389  -0.099  1.00  0.00           C  
HETATM   12  S   UNL     1      -3.472   1.197   1.455  1.00  0.00           S  
HETATM   13  C   UNL     1      -2.450   0.581  -0.798  1.00  0.00           C  
HETATM   14  C   UNL     1       0.134   2.946   1.401  1.00  0.00           C  
HETATM   15  N   UNL     1       0.312   1.423  -1.822  1.00  0.00           N  
HETATM   16  C   UNL     1       1.658   1.962  -2.062  1.00  0.00           C  
HETATM   17  C   UNL     1       2.636   1.355  -1.054  1.00  0.00           C  
HETATM   18  C   UNL     1       0.304  -0.041  -1.956  1.00  0.00           C  
HETATM   19  C   UNL     1       1.282  -0.649  -0.947  1.00  0.00           C  
HETATM   20  N   UNL     1       2.627  -0.109  -1.188  1.00  0.00           N  
HETATM   21  C   UNL     1       3.556  -0.691  -0.337  1.00  0.00           C  
HETATM   22  S   UNL     1       5.283  -0.333  -0.279  1.00  0.00           S  
HETATM   23  N   UNL     1       3.309  -1.597   0.565  1.00  0.00           N  
HETATM   24  N   UNL     1       4.279  -2.016   1.253  1.00  0.00           N  
HETATM   25  C   UNL     1       5.450  -1.519   1.017  1.00  0.00           C  
HETATM   26  C   UNL     1       6.728  -1.885   1.727  1.00  0.00           C  
HETATM   27  H   UNL     1      -4.792  -0.371  -1.661  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.644  -0.029  -0.136  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.306   0.163  -1.784  1.00  0.00           H  
HETATM   30  H   UNL     1       0.766   3.565   2.021  1.00  0.00           H  
HETATM   31  H   UNL     1       1.976   1.711  -3.074  1.00  0.00           H  
HETATM   32  H   UNL     1       1.641   3.046  -1.944  1.00  0.00           H  
HETATM   33  H   UNL     1       3.640   1.732  -1.248  1.00  0.00           H  
HETATM   34  H   UNL     1       2.334   1.630  -0.043  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.700  -0.418  -1.761  1.00  0.00           H  
HETATM   36  H   UNL     1       0.606  -0.315  -2.966  1.00  0.00           H  
HETATM   37  H   UNL     1       0.964  -0.397   0.064  1.00  0.00           H  
HETATM   38  H   UNL     1       1.298  -1.732  -1.065  1.00  0.00           H  
HETATM   39  H   UNL     1       6.860  -1.237   2.594  1.00  0.00           H  
HETATM   40  H   UNL     1       6.678  -2.923   2.053  1.00  0.00           H  
HETATM   41  H   UNL     1       7.570  -1.757   1.047  1.00  0.00           H  
CONECT    1   12    5    5    2                                       
CONECT    2    1   13    3    3                                       
CONECT    3    2    2    4   15                                       
CONECT    4   14   14    3                                            
CONECT    5    1    1   14                                            
CONECT    6    7                                                      
CONECT    7   10    9    6    8                                       
CONECT    8    7                                                      
CONECT    9    7                                                      
CONECT   10   11    7   27   28                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11    1                                                 
CONECT   13   11   11    2   29                                       
CONECT   14    5    4    4   30                                       
CONECT   15   18    3   16                                            
CONECT   16   15   17   31   32                                       
CONECT   17   20   16   33   34                                       
CONECT   18   19   15   35   36                                       
CONECT   19   18   20   37   38                                       
CONECT   20   19   21   17                                            
CONECT   21   22   20   23   23                                       
CONECT   22   25   21                                                 
CONECT   23   21   21   24                                            
CONECT   24   25   25   23                                            
CONECT   25   26   22   24   24                                       
CONECT   26   25   39   40   41                                       
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   16                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   26                                                      
CONECT   40   26                                                      
CONECT   41   26                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
