COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.132  -0.340   0.002  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.967   0.724  -0.017  1.00  0.00           C  
HETATM    3  C   UNL     1       2.530  -0.678   0.006  1.00  0.00           C  
HETATM    4  C   UNL     1       3.860   0.029  -0.008  1.00  0.00           C  
HETATM    5  N   UNL     1       1.447   0.315  -0.011  1.00  0.00           N  
HETATM    6  N   UNL     1       5.003  -0.685   0.005  1.00  0.00           N  
HETATM    7  O   UNL     1      -2.818  -0.722   1.249  1.00  0.00           O  
HETATM    8  O   UNL     1      -3.588   1.066  -0.022  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.820  -0.768  -1.225  1.00  0.00           O  
HETATM   10  O   UNL     1       3.903   1.241  -0.031  1.00  0.00           O  
HETATM   11  S   UNL     1      -2.591  -0.084  -0.001  1.00  0.00           S  
HETATM   12  H   UNL     1       0.036  -0.945   0.904  1.00  0.00           H  
HETATM   13  H   UNL     1       0.035  -0.978  -0.876  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.870   1.363   0.861  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.872   1.329  -0.919  1.00  0.00           H  
HETATM   16  H   UNL     1       2.449  -1.319  -0.872  1.00  0.00           H  
HETATM   17  H   UNL     1       2.451  -1.286   0.908  1.00  0.00           H  
HETATM   18  H   UNL     1       1.537   0.961   0.758  1.00  0.00           H  
HETATM   19  H   UNL     1       4.969  -1.655   0.023  1.00  0.00           H  
HETATM   20  H   UNL     1       5.860  -0.230  -0.004  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.513   0.785  -0.016  1.00  0.00           H  
CONECT    1    5    2   12   13                                       
CONECT    2    1   11   14   15                                       
CONECT    3    5    4   16   17                                       
CONECT    4   10   10    3    6                                       
CONECT    5    3    1   18                                            
CONECT    6    4   19   20                                            
CONECT    7   11   11                                                 
CONECT    8   11   21                                                 
CONECT    9   11   11                                                 
CONECT   10    4    4                                                 
CONECT   11    2    7    7    9                                       
CONECT   11    9    8                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    3                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    6                                                      
CONECT   21    8                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
