COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.352   0.692   2.089  1.00  0.00           N  
HETATM    2  C   UNL     1       7.594   0.652   0.975  1.00  0.00           C  
HETATM    3  O   UNL     1       8.066   0.983  -0.092  1.00  0.00           O  
HETATM    4  C   UNL     1       6.160   0.196   1.056  1.00  0.00           C  
HETATM    5  O   UNL     1       5.572   0.241  -0.246  1.00  0.00           O  
HETATM    6  C   UNL     1       4.270  -0.142  -0.349  1.00  0.00           C  
HETATM    7  C   UNL     1       3.955  -1.472  -0.592  1.00  0.00           C  
HETATM    8  F   UNL     1       4.941  -2.386  -0.728  1.00  0.00           F  
HETATM    9  C   UNL     1       2.632  -1.862  -0.697  1.00  0.00           C  
HETATM   10  C   UNL     1       1.618  -0.923  -0.558  1.00  0.00           C  
HETATM   11  S   UNL     1      -0.067  -1.419  -0.689  1.00  0.00           S  
HETATM   12  C   UNL     1      -0.970   0.134  -0.440  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.475  -0.132  -0.526  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.204   1.123  -0.324  1.00  0.00           N  
HETATM   15  S   UNL     1      -4.808   1.222  -0.726  1.00  0.00           S  
HETATM   16  O   UNL     1      -5.227   2.536  -0.383  1.00  0.00           O  
HETATM   17  O   UNL     1      -4.927   0.685  -2.036  1.00  0.00           O  
HETATM   18  C   UNL     1      -5.682   0.126   0.342  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.168   0.584   1.553  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.854  -0.276   2.391  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.053  -1.592   2.019  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.567  -2.049   0.808  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.886  -1.188  -0.033  1.00  0.00           C  
HETATM   24  C   UNL     1       1.934   0.408  -0.314  1.00  0.00           C  
HETATM   25  C   UNL     1       3.257   0.796  -0.205  1.00  0.00           C  
HETATM   26  F   UNL     1       3.564   2.089   0.038  1.00  0.00           F  
HETATM   27  H   UNL     1       7.975   0.428   2.942  1.00  0.00           H  
HETATM   28  H   UNL     1       9.277   0.982   2.036  1.00  0.00           H  
HETATM   29  H   UNL     1       6.124  -0.825   1.436  1.00  0.00           H  
HETATM   30  H   UNL     1       5.607   0.853   1.727  1.00  0.00           H  
HETATM   31  H   UNL     1       2.388  -2.897  -0.886  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.729   0.541   0.543  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.683   0.850  -1.210  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.716  -0.538  -1.508  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.762  -0.847   0.244  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.748   1.895   0.045  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.012   1.612   1.844  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.234   0.081   3.337  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.589  -2.263   2.674  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.722  -3.077   0.517  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.510  -1.544  -0.980  1.00  0.00           H  
HETATM   42  H   UNL     1       1.146   1.139  -0.207  1.00  0.00           H  
CONECT    1    2   27   28                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   29   30                                       
CONECT    5    4    6                                                 
CONECT    6    5    7    7   25                                       
CONECT    7    6    6    8    9                                       
CONECT    8    7                                                      
CONECT    9    7   10   10   31                                       
CONECT   10    9    9   11   24                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   32   33                                       
CONECT   13   12   14   34   35                                       
CONECT   14   13   15   36                                            
CONECT   15   14   16   16   17                                       
CONECT   15   17   18                                                 
CONECT   16   15   15                                                 
CONECT   17   15   15                                                 
CONECT   18   15   23   23   19                                       
CONECT   19   18   20   20   37                                       
CONECT   20   19   19   21   38                                       
CONECT   21   20   22   22   39                                       
CONECT   22   21   21   23   40                                       
CONECT   23   18   18   22   41                                       
CONECT   24   10   25   25   42                                       
CONECT   25    6   24   24   26                                       
CONECT   26   25                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
