COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       2.180  -0.768  -0.144  1.00  0.00           S  
HETATM    2  O   UNL     1       1.450  -0.198   1.064  1.00  0.00           O  
HETATM    3  O   UNL     1       1.171  -1.318  -0.980  1.00  0.00           O  
HETATM    4  O   UNL     1       3.294  -1.479   0.377  1.00  0.00           O  
HETATM    5  O   UNL     1       2.763   0.405  -0.919  1.00  0.00           O  
HETATM    6  O   UNL     1       1.366   2.445   0.291  1.00  0.00           O  
HETATM    7  O   UNL     1      -3.221  -1.886   0.327  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.296  -0.236  -0.428  1.00  0.00           O1-
HETATM    9  C   UNL     1      -0.856  -0.435   0.532  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.256  -0.718  -0.017  1.00  0.00           N1+
HETATM   11  C   UNL     1      -0.939   2.221  -0.251  1.00  0.00           C  
HETATM   12  C   UNL     1       0.290   0.341   0.604  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.076   1.440  -0.326  1.00  0.00           C  
HETATM   14  C   UNL     1       0.246   1.677   0.216  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.035   0.114   0.065  1.00  0.00           C  
HETATM   16  H   UNL     1       3.224   0.034  -1.683  1.00  0.00           H  
HETATM   17  H   UNL     1       1.370   2.850   1.169  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.826  -1.471   0.837  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.974   3.257  -0.557  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.000   1.865  -0.691  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    4    5                                                 
CONECT    2    1   12                                                 
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    1   16                                                 
CONECT    6   14   17                                                 
CONECT    7   10   10                                                 
CONECT    8   10                                                      
CONECT    9   12   12   15   18                                       
CONECT   10    7    7    8   15                                       
CONECT   11   13   14   14   19                                       
CONECT   12    2    9    9   14                                       
CONECT   13   11   15   15   20                                       
CONECT   14    6   11   11   12                                       
CONECT   15    9   10   13   13                                       
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    9                                                      
CONECT   19   11                                                      
CONECT   20   13                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
