COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.099   0.426  -0.006  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.617  -0.871  -0.042  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.258  -1.106  -0.036  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.367  -0.032   0.006  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.860   1.274   0.043  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.221   1.495   0.036  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.910  -0.276   0.014  1.00  0.00           C  
HETATM    8  C   UNL     1       0.045   0.694   0.054  1.00  0.00           C  
HETATM    9  C   UNL     1       1.340   0.229   0.053  1.00  0.00           C  
HETATM   10  C   UNL     1       1.451  -1.140   0.012  1.00  0.00           C  
HETATM   11  S   UNL     1      -0.152  -1.862  -0.021  1.00  0.00           S  
HETATM   12  C   UNL     1       2.671  -1.859   0.003  1.00  0.00           C  
HETATM   13  O   UNL     1       3.731  -1.261   0.033  1.00  0.00           O  
HETATM   14  N   UNL     1       2.658  -3.206  -0.039  1.00  0.00           N  
HETATM   15  N   UNL     1       2.448   1.077   0.091  1.00  0.00           N  
HETATM   16  C   UNL     1       2.280   2.410  -0.016  1.00  0.00           C  
HETATM   17  O   UNL     1       1.160   2.881  -0.052  1.00  0.00           O  
HETATM   18  N   UNL     1       3.355   3.221  -0.084  1.00  0.00           N  
HETATM   19  H   UNL     1      -6.164   0.604  -0.016  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.307  -1.701  -0.075  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.883  -2.118  -0.064  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.176   2.109   0.076  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.604   2.504   0.064  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.195   1.747   0.083  1.00  0.00           H  
HETATM   25  H   UNL     1       1.814  -3.683  -0.062  1.00  0.00           H  
HETATM   26  H   UNL     1       3.493  -3.699  -0.045  1.00  0.00           H  
HETATM   27  H   UNL     1       3.339   0.707   0.195  1.00  0.00           H  
HETATM   28  H   UNL     1       4.249   2.845  -0.055  1.00  0.00           H  
HETATM   29  H   UNL     1       3.234   4.181  -0.161  1.00  0.00           H  
CONECT    1    2    2    6   19                                       
CONECT    2    1    1    3   20                                       
CONECT    3    2    4    4   21                                       
CONECT    4    3    3    5    7                                       
CONECT    5    4    6    6   22                                       
CONECT    6    1    5    5   23                                       
CONECT    7    4    8    8   11                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10   10   15                                       
CONECT   10    9    9   11   12                                       
CONECT   11    7   10                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   25   26                                            
CONECT   15    9   16   27                                            
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   28   29                                            
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    3                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25   14                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   18                                                      
CONECT   29   18                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
