COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.780   0.626   0.045  1.00  0.00           C  
HETATM    2  C   UNL     1       1.342   0.097  -0.061  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.049  -0.413  -0.017  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.389  -0.031   0.016  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.803  -0.551   0.044  1.00  0.00           C  
HETATM    6  N   UNL     1       3.617   0.222   1.483  1.00  0.00           N  
HETATM    7  N   UNL     1       0.530   1.106  -0.061  1.00  0.00           N  
HETATM    8  N   UNL     1      -0.703   0.839  -0.038  1.00  0.00           N  
HETATM    9  N   UNL     1      -2.354  -0.893   0.010  1.00  0.00           N  
HETATM   10  O   UNL     1       3.552  -1.058  -0.626  1.00  0.00           O  
HETATM   11  O   UNL     1       3.436   1.438  -0.656  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.183   1.164  -0.002  1.00  0.00           O  
HETATM   13  S   UNL     1       3.102   0.179  -0.090  1.00  0.00           S  
HETATM   14  S   UNL     1       0.369  -1.374  -0.019  1.00  0.00           S  
HETATM   15  H   UNL     1      -5.631   1.223  -0.855  1.00  0.00           H  
HETATM   16  H   UNL     1      -6.803   0.250   0.066  1.00  0.00           H  
HETATM   17  H   UNL     1      -5.603   1.245   0.925  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.953  -1.148   0.944  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.981  -1.170  -0.836  1.00  0.00           H  
HETATM   20  H   UNL     1       4.478  -0.156   1.722  1.00  0.00           H  
HETATM   21  H   UNL     1       3.057   0.625   2.166  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.518  -1.849   0.024  1.00  0.00           H  
CONECT    1    5   15   16   17                                       
CONECT    2   14    7    7   13                                       
CONECT    3    9    8    8   14                                       
CONECT    4    5   12   12    9                                       
CONECT    5    1    4   18   19                                       
CONECT    6   13   20   21                                            
CONECT    7    8    2    2                                            
CONECT    8    3    3    7                                            
CONECT    9    4    3   22                                            
CONECT   10   13   13                                                 
CONECT   11   13   13                                                 
CONECT   12    4    4                                                 
CONECT   13    2    6   11   11                                       
CONECT   13   10   10                                                 
CONECT   14    3    2                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    9                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
