COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.222  -0.547   0.589  1.00  0.00           C  
HETATM    2  C   UNL     1       5.904  -0.877  -0.596  1.00  0.00           C  
HETATM    3  N   UNL     1       5.262  -0.858  -1.762  1.00  0.00           N  
HETATM    4  C   UNL     1       3.990  -0.536  -1.844  1.00  0.00           C  
HETATM    5  C   UNL     1       3.255  -0.198  -0.711  1.00  0.00           C  
HETATM    6  C   UNL     1       3.878  -0.208   0.532  1.00  0.00           C  
HETATM    7  N   UNL     1       6.146  -0.659   1.608  1.00  0.00           N  
HETATM    8  C   UNL     1       7.324  -1.039   1.044  1.00  0.00           C  
HETATM    9  N   UNL     1       7.183  -1.166  -0.244  1.00  0.00           N  
HETATM   10  N   UNL     1       1.902   0.142  -0.822  1.00  0.00           N  
HETATM   11  C   UNL     1       1.332   0.949   0.095  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.120   1.204   0.053  1.00  0.00           C  
HETATM   13  O   UNL     1       2.016   1.467   0.958  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.999   0.378   0.759  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.364   0.629   0.718  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.852   1.699  -0.021  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.984   2.518  -0.720  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.624   2.279  -0.688  1.00  0.00           C  
HETATM   19  F   UNL     1       0.220   3.086  -1.368  1.00  0.00           F  
HETATM   20  F   UNL     1      -0.522  -0.663   1.477  1.00  0.00           F  
HETATM   21  N   UNL     1      -3.249  -0.196   1.422  1.00  0.00           N  
HETATM   22  S   UNL     1      -4.743  -0.536   0.793  1.00  0.00           S  
HETATM   23  C   UNL     1      -4.392  -1.354  -0.788  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.709  -1.722  -1.475  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.414  -2.412  -2.808  1.00  0.00           C  
HETATM   26  O   UNL     1      -5.310  -1.456   1.715  1.00  0.00           O  
HETATM   27  O   UNL     1      -5.330   0.740   0.575  1.00  0.00           O  
HETATM   28  H   UNL     1       3.506  -0.533  -2.810  1.00  0.00           H  
HETATM   29  H   UNL     1       3.332   0.049   1.428  1.00  0.00           H  
HETATM   30  H   UNL     1       5.985  -0.495   2.550  1.00  0.00           H  
HETATM   31  H   UNL     1       8.242  -1.210   1.586  1.00  0.00           H  
HETATM   32  H   UNL     1       1.373  -0.203  -1.559  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.914   1.891  -0.051  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.371   3.347  -1.294  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.987  -0.569   2.278  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.825  -0.678  -1.429  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.811  -2.258  -0.609  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.277  -2.397  -0.834  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.291  -0.817  -1.654  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.846  -1.736  -3.449  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.832  -3.316  -2.628  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.352  -2.674  -3.297  1.00  0.00           H  
CONECT    1    6    6    2    7                                       
CONECT    2    3    3    1    9                                       
CONECT    3    4    2    2                                            
CONECT    4    5    5    3   28                                       
CONECT    5   10    4    4    6                                       
CONECT    6    5    1    1   29                                       
CONECT    7    1    8   30                                            
CONECT    8    7    9    9   31                                       
CONECT    9    2    8    8                                            
CONECT   10   11    5   32                                            
CONECT   11   12   10   13   13                                       
CONECT   12   14   14   18   11                                       
CONECT   13   11   11                                                 
CONECT   14   15   20   12   12                                       
CONECT   15   21   16   16   14                                       
CONECT   16   15   15   17   33                                       
CONECT   17   16   18   18   34                                       
CONECT   18   17   17   12   19                                       
CONECT   19   18                                                      
CONECT   20   14                                                      
CONECT   21   22   15   35                                            
CONECT   22   26   26   27   27                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   36   37                                       
CONECT   24   25   23   38   39                                       
CONECT   25   24   40   41   42                                       
CONECT   26   22   22                                                 
CONECT   27   22   22                                                 
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   21                                                      
CONECT   36   23                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   25                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
