COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.235   1.325  -0.029  1.00  0.00           C  
HETATM    2  C   UNL     1       0.372  -1.085  -0.053  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.006  -1.156  -0.064  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.142   1.240  -0.052  1.00  0.00           C  
HETATM    5  C   UNL     1       1.003   0.160  -0.029  1.00  0.00           C  
HETATM    6  C   UNL     1       2.479   0.243  -0.005  1.00  0.00           C  
HETATM    7  C   UNL     1       3.224   1.378   0.025  1.00  0.00           C  
HETATM    8  N   UNL     1       4.515   1.012   0.045  1.00  0.00           N  
HETATM    9  C   UNL     1       4.585  -0.290   0.029  1.00  0.00           C  
HETATM   10  O   UNL     1       3.344  -0.794  -0.002  1.00  0.00           O  
HETATM   11  C   UNL     1       5.857  -1.097   0.043  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.762   0.003  -0.069  1.00  0.00           C  
HETATM   13  S   UNL     1      -3.521  -0.097  -0.085  1.00  0.00           S  
HETATM   14  O   UNL     1      -3.987   1.129  -0.632  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.846  -1.367  -0.633  1.00  0.00           O  
HETATM   16  N   UNL     1      -4.024  -0.126   1.493  1.00  0.00           N  
HETATM   17  H   UNL     1       0.717   2.291  -0.016  1.00  0.00           H  
HETATM   18  H   UNL     1       0.960  -1.990  -0.049  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.496  -2.119  -0.068  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.737   2.141  -0.057  1.00  0.00           H  
HETATM   21  H   UNL     1       2.848   2.390   0.030  1.00  0.00           H  
HETATM   22  H   UNL     1       6.144  -1.306   1.073  1.00  0.00           H  
HETATM   23  H   UNL     1       5.698  -2.036  -0.487  1.00  0.00           H  
HETATM   24  H   UNL     1       6.651  -0.534  -0.448  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.887   0.246   1.734  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.455  -0.514   2.176  1.00  0.00           H  
CONECT    1    5    4    4   17                                       
CONECT    2    5    5    3   18                                       
CONECT    3    2   12   12   19                                       
CONECT    4    1    1   12   20                                       
CONECT    5    6    2    2    1                                       
CONECT    6    7    7   10    5                                       
CONECT    7    8    6    6   21                                       
CONECT    8    7    9    9                                            
CONECT    9    8    8   11   10                                       
CONECT   10    9    6                                                 
CONECT   11    9   22   23   24                                       
CONECT   12    3    3    4   13                                       
CONECT   13   12   16   15   15                                       
CONECT   13   14   14                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   13   25   26                                            
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    7                                                      
CONECT   22   11                                                      
CONECT   23   11                                                      
CONECT   24   11                                                      
CONECT   25   16                                                      
CONECT   26   16                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
