COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.690   0.158  -0.010  1.00  0.00           C  
HETATM    2  N   UNL     1       0.111   0.546  -0.152  1.00  0.00           N  
HETATM    3  S   UNL     1       1.430  -1.541   0.153  1.00  0.00           S  
HETATM    4  N   UNL     1       1.682   2.319  -0.342  1.00  0.00           N  
HETATM    5  N   UNL     1      -1.300  -1.350   0.059  1.00  0.00           N  
HETATM    6  C   UNL     1       2.290  -0.014  -0.023  1.00  0.00           C  
HETATM    7  C   UNL     1       1.350   0.982  -0.177  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.068  -0.732   0.010  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.468  -0.582   0.055  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.631  -1.087  -0.512  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.783  -0.326  -0.514  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.780   0.938   0.047  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.623   1.444   0.612  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.469   0.685   0.623  1.00  0.00           C  
HETATM   15  O   UNL     1       4.168   1.271  -0.142  1.00  0.00           O  
HETATM   16  N   UNL     1       4.499  -0.908   0.154  1.00  0.00           N  
HETATM   17  H   UNL     1       0.982   2.983  -0.446  1.00  0.00           H  
HETATM   18  H   UNL     1       2.613   2.591  -0.353  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.356  -2.318   0.097  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.634  -2.074  -0.951  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.688  -0.718  -0.955  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.682   1.532   0.043  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.624   2.432   1.049  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.568   1.079   1.069  1.00  0.00           H  
HETATM   25  H   UNL     1       4.118  -1.793   0.263  1.00  0.00           H  
HETATM   26  H   UNL     1       5.462  -0.789   0.163  1.00  0.00           H  
CONECT    1    6   15   15   16                                       
CONECT    2    7    8    8                                            
CONECT    3    6    8                                                 
CONECT    4    7   17   18                                            
CONECT    5    8    9   19                                            
CONECT    6    1    3    7    7                                       
CONECT    7    2    4    6    6                                       
CONECT    8    2    2    3    5                                       
CONECT    9    5   10   10   14                                       
CONECT   10    9    9   11   20                                       
CONECT   11   10   12   12   21                                       
CONECT   12   11   11   13   22                                       
CONECT   13   12   14   14   23                                       
CONECT   14    9   13   13   24                                       
CONECT   15    1    1                                                 
CONECT   16    1   25   26                                            
CONECT   17    4                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   12                                                      
CONECT   23   13                                                      
CONECT   24   14                                                      
CONECT   25   16                                                      
CONECT   26   16                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
