COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.545   0.372   0.006  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.251   1.300   0.000  1.00  0.00           C  
HETATM    3  S   UNL     1      -4.606  -0.396  -0.001  1.00  0.00           S  
HETATM    4  C   UNL     1      -2.861  -0.156  -0.001  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.259   0.993  -0.001  1.00  0.00           N  
HETATM    6  N   UNL     1      -0.882   0.945  -0.001  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.364  -0.243  -0.002  1.00  0.00           C  
HETATM    8  S   UNL     1      -1.655  -1.439   0.005  1.00  0.00           S  
HETATM    9  N   UNL     1       0.999  -0.527  -0.003  1.00  0.00           N  
HETATM   10  C   UNL     1       1.897   0.478  -0.002  1.00  0.00           C  
HETATM   11  O   UNL     1       1.516   1.634  -0.001  1.00  0.00           O  
HETATM   12  C   UNL     1       3.332   0.179  -0.003  1.00  0.00           C  
HETATM   13  C   UNL     1       4.343   1.096   0.007  1.00  0.00           C  
HETATM   14  C   UNL     1       5.220  -0.939  -0.004  1.00  0.00           C  
HETATM   15  O   UNL     1       3.885  -1.052  -0.004  1.00  0.00           O  
HETATM   16  H   UNL     1       6.543   0.785   0.007  1.00  0.00           H  
HETATM   17  H   UNL     1      -6.340   1.274   0.000  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.899   1.822   0.890  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.900   1.822  -0.890  1.00  0.00           H  
HETATM   20  H   UNL     1       1.302  -1.448  -0.004  1.00  0.00           H  
HETATM   21  H   UNL     1       4.238   2.171   0.014  1.00  0.00           H  
HETATM   22  H   UNL     1       5.920  -1.761  -0.011  1.00  0.00           H  
CONECT    1   13   14   14   16                                       
CONECT    2    3   17   18   19                                       
CONECT    3    4    2                                                 
CONECT    4    8    3    5    5                                       
CONECT    5    4    4    6                                            
CONECT    6    7    7    5                                            
CONECT    7    8    9    6    6                                       
CONECT    8    7    4                                                 
CONECT    9    7   10   20                                            
CONECT   10    9   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   13   13   10   15                                       
CONECT   13   12   12    1   21                                       
CONECT   14    1    1   15   22                                       
CONECT   15   12   14                                                 
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    9                                                      
CONECT   21   13                                                      
CONECT   22   14                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
