COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.868  -1.140   0.001  1.00  0.00           O  
HETATM    2  C   UNL     1       3.147   0.044   0.001  1.00  0.00           C  
HETATM    3  C   UNL     1       4.590   0.478  -0.005  1.00  0.00           C  
HETATM    4  N   UNL     1       2.179   0.954   0.001  1.00  0.00           N  
HETATM    5  C   UNL     1       0.905   0.571   0.000  1.00  0.00           C  
HETATM    6  S   UNL     1       0.323  -1.048   0.001  1.00  0.00           S  
HETATM    7  C   UNL     1      -1.388  -0.605   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.426   0.791  -0.001  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.176   1.378   0.005  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.550  -1.357   0.000  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.778  -0.726  -0.001  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.836   0.657  -0.002  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.684   1.410  -0.002  1.00  0.00           C  
HETATM   14  H   UNL     1       4.934   0.584  -1.034  1.00  0.00           H  
HETATM   15  H   UNL     1       4.684   1.434   0.510  1.00  0.00           H  
HETATM   16  H   UNL     1       5.197  -0.270   0.506  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.078   2.343   0.010  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.495  -2.436   0.000  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.750   2.488  -0.003  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.688  -1.308  -0.001  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.796   1.151  -0.002  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   14   15   16                                       
CONECT    4    2    5    5                                            
CONECT    5    4    4    6    9                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   10   10                                       
CONECT    8    7    9   13   13                                       
CONECT    9    5    8   17                                            
CONECT   10    7    7   11   18                                       
CONECT   11   10   12   12   20                                       
CONECT   12   11   11   13   21                                       
CONECT   13    8    8   12   19                                       
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    3                                                      
CONECT   17    9                                                      
CONECT   18   10                                                      
CONECT   19   13                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
