COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.393  -0.062   0.056  1.00  0.00           C  
HETATM    2  C   UNL     1       0.386   1.082   0.052  1.00  0.00           C  
HETATM    3  C   UNL     1       1.761   0.983   0.018  1.00  0.00           C  
HETATM    4  N   UNL     1       4.434   0.644  -0.050  1.00  0.00           N  
HETATM    5  N   UNL     1       3.733  -0.379  -0.046  1.00  0.00           N  
HETATM    6  C   UNL     1       2.367  -0.274  -0.012  1.00  0.00           C  
HETATM    7  C   UNL     1       1.576  -1.424  -0.008  1.00  0.00           C  
HETATM    8  C   UNL     1       0.201  -1.311   0.032  1.00  0.00           C  
HETATM    9  S   UNL     1      -2.149   0.073   0.100  1.00  0.00           S  
HETATM   10  O   UNL     1      -2.632  -1.150   0.640  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.440   1.342   0.667  1.00  0.00           O  
HETATM   12  N   UNL     1      -2.676   0.130  -1.469  1.00  0.00           N  
HETATM   13  H   UNL     1      -0.085   2.053   0.075  1.00  0.00           H  
HETATM   14  H   UNL     1       2.368   1.877   0.014  1.00  0.00           H  
HETATM   15  H   UNL     1       4.015   1.519  -0.030  1.00  0.00           H  
HETATM   16  H   UNL     1       2.038  -2.400  -0.031  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.412  -2.200   0.036  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.036   0.089  -2.197  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.624   0.205  -1.660  1.00  0.00           H  
CONECT    1    8    8    2    9                                       
CONECT    2    3    3    1   13                                       
CONECT    3    6    2    2   14                                       
CONECT    4    5    5   15                                            
CONECT    5    4    4    6                                            
CONECT    6    5    7    7    3                                       
CONECT    7    6    6    8   16                                       
CONECT    8    7    1    1   17                                       
CONECT    9    1   12   11   11                                       
CONECT    9   10   10                                                 
CONECT   10    9    9                                                 
CONECT   11    9    9                                                 
CONECT   12    9   18   19                                            
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    4                                                      
CONECT   16    7                                                      
CONECT   17    8                                                      
CONECT   18   12                                                      
CONECT   19   12                                                      
MASTER        0    0    0    0    0    0    0    0   19    0   19    0
END
