COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       1.741   1.157  -0.095  1.00  0.00           S  
HETATM    2  O   UNL     1       1.235   2.485  -0.092  1.00  0.00           O  
HETATM    3  O   UNL     1       2.591   0.651  -1.115  1.00  0.00           O  
HETATM    4  N   UNL     1       2.558   0.965   1.332  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.861  -1.582   0.042  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.035  -0.212   0.004  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.935   0.625  -0.038  1.00  0.00           C  
HETATM    8  C   UNL     1       0.339   0.091  -0.041  1.00  0.00           C  
HETATM    9  C   UNL     1       0.515  -1.281  -0.004  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.586  -2.118   0.038  1.00  0.00           C  
HETATM   11 CL   UNL     1       2.115  -1.953  -0.009  1.00  0.00          Cl  
HETATM   12  N   UNL     1      -3.400   0.361   0.008  1.00  0.00           N1+
HETATM   13  O   UNL     1      -3.554   1.568  -0.026  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.370  -0.376   0.044  1.00  0.00           O1-
HETATM   15  H   UNL     1       2.342   1.525   2.094  1.00  0.00           H  
HETATM   16  H   UNL     1       3.253   0.292   1.406  1.00  0.00           H  
HETATM   17  H   UNL     1      -2.720  -2.235   0.079  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.072   1.696  -0.067  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.450  -3.188   0.072  1.00  0.00           H  
CONECT    1    8    4    2    2                                       
CONECT    1    3    3                                                 
CONECT    2    1    1                                                 
CONECT    3    1    1                                                 
CONECT    4    1   15   16                                            
CONECT    5    6    6   10   17                                       
CONECT    6   12    5    5    7                                       
CONECT    7    6    8    8   18                                       
CONECT    8    7    7    9    1                                       
CONECT    9   10   10    8   11                                       
CONECT   10    5    9    9   19                                       
CONECT   11    9                                                      
CONECT   12   13   13   14    6                                       
CONECT   13   12   12                                                 
CONECT   14   12                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19   10                                                      
MASTER        0    0    0    0    0    0    0    0   19    0   19    0
END
