COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.076   0.649  -0.960  1.00  0.00           C  
HETATM    2  O   UNL     1       0.543   1.523   0.772  1.00  0.00           O  
HETATM    3  C   UNL     1       0.840   0.435   0.316  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.126  -0.457   0.020  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.533  -0.117   0.247  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.351  -1.401   0.422  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.773  -1.016   0.838  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.300   0.053  -0.075  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.497   0.246  -0.103  1.00  0.00           O  
HETATM   10  N   UNL     1      -3.522   0.803  -0.858  1.00  0.00           N  
HETATM   11  C   UNL     1       2.253   0.093   0.088  1.00  0.00           C  
HETATM   12  C   UNL     1       3.273   0.936   0.367  1.00  0.00           C  
HETATM   13  S   UNL     1       4.747   0.172  -0.037  1.00  0.00           S  
HETATM   14  C   UNL     1       3.919  -1.229  -0.555  1.00  0.00           C  
HETATM   15  N   UNL     1       2.649  -1.082  -0.409  1.00  0.00           N  
HETATM   16  H   UNL     1      -1.612   1.634  -1.000  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.836   0.103  -1.872  1.00  0.00           H  
HETATM   18  H   UNL     1       0.110  -1.325  -0.344  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.620   0.500   1.141  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.380  -1.950  -0.519  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.899  -2.022   1.196  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.418  -1.893   0.778  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.763  -0.643   1.862  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.945   1.493  -1.392  1.00  0.00           H  
HETATM   25  H   UNL     1       3.171   1.930   0.777  1.00  0.00           H  
HETATM   26  H   UNL     1       4.395  -2.116  -0.946  1.00  0.00           H  
CONECT    1   10    5   16   17                                       
CONECT    2    3    3                                                 
CONECT    3    2    2   11    4                                       
CONECT    4    3    5   18                                            
CONECT    5    1    4    6   19                                       
CONECT    6    5    7   20   21                                       
CONECT    7    8    6   22   23                                       
CONECT    8   10    9    9    7                                       
CONECT    9    8    8                                                 
CONECT   10    1    8   24                                            
CONECT   11   12   12    3   15                                       
CONECT   12   13   11   11   25                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   15   26                                       
CONECT   15   11   14   14                                            
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24   10                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
