COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.699  -1.520  -0.570  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.585  -1.138  -0.885  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.708  -1.289  -2.286  1.00  0.00           C  
HETATM    4  C   UNL     1       0.510  -1.752  -2.729  1.00  0.00           C  
HETATM    5  C   UNL     1       0.880  -2.056  -4.065  1.00  0.00           C  
HETATM    6  N   UNL     1       2.070  -2.495  -4.398  1.00  0.00           N  
HETATM    7  N   UNL     1       2.036  -2.669  -5.769  1.00  0.00           N  
HETATM    8  C   UNL     1       0.828  -2.321  -6.146  1.00  0.00           C  
HETATM    9  S   UNL     1       0.281  -2.365  -7.796  1.00  0.00           S  
HETATM   10  C   UNL     1      -1.424  -1.775  -7.610  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.088  -1.738  -8.956  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.049  -0.784  -9.041  1.00  0.00           O  
HETATM   13  O   UNL     1      -1.809  -2.495  -9.878  1.00  0.00           O  
HETATM   14  O   UNL     1       0.032  -1.918  -5.118  1.00  0.00           O  
HETATM   15  O   UNL     1       1.372  -1.896  -1.689  1.00  0.00           O  
HETATM   16  N   UNL     1       1.422  -1.597   0.622  1.00  0.00           N1+
HETATM   17  O   UNL     1       0.870  -1.266   1.712  1.00  0.00           O1-
HETATM   18  O   UNL     1       2.622  -1.998   0.602  1.00  0.00           O  
HETATM   19  H   UNL     1      -3.512  -0.739  -9.904  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.424  -0.765  -7.187  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.988  -2.416  -6.927  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.580  -1.082  -2.891  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.341  -0.794  -0.193  1.00  0.00           H  
CONECT    1    2    2   15   16                                       
CONECT    2    1    1    3   23                                       
CONECT    3    2    4    4   22                                       
CONECT    4    3    3    5   15                                       
CONECT    5    4    6    6   14                                       
CONECT    6    5    5    7                                            
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   14                                       
CONECT    9    8   10                                                 
CONECT   10    9   11   20   21                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11   19                                                 
CONECT   13   11   11                                                 
CONECT   14    5    8                                                 
CONECT   15    1    4                                                 
CONECT   16    1   17   18   18                                       
CONECT   17   16                                                      
CONECT   18   16   16                                                 
CONECT   19   12                                                      
CONECT   20   10                                                      
CONECT   21   10                                                      
CONECT   22    3                                                      
CONECT   23    2                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
