COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.139  -0.013  -0.006  1.00  0.00           C  
HETATM    2  C   UNL     1       2.088  -0.962   0.001  1.00  0.00           C  
HETATM    3  C   UNL     1       1.105  -1.974   0.004  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.228  -1.648   0.008  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.630  -0.320   0.008  1.00  0.00           C  
HETATM    6  C   UNL     1       0.313   0.685   0.005  1.00  0.00           C  
HETATM    7  C   UNL     1       1.670   0.372   0.012  1.00  0.00           C  
HETATM    8  I   UNL     1      -2.670   0.157  -0.002  1.00  0.00           I  
HETATM    9  N   UNL     1       5.518   0.023  -0.011  1.00  0.00           N  
HETATM   10  N   UNL     1       3.431  -1.090  -0.004  1.00  0.00           N  
HETATM   11  S   UNL     1       3.098   1.404   0.004  1.00  0.00           S  
HETATM   12  H   UNL     1       1.403  -3.011   0.003  1.00  0.00           H  
HETATM   13  H   UNL     1      -0.970  -2.432   0.010  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.001   1.718   0.006  1.00  0.00           H  
HETATM   15  H   UNL     1       6.025  -0.804  -0.012  1.00  0.00           H  
HETATM   16  H   UNL     1       5.982   0.875  -0.013  1.00  0.00           H  
CONECT    1   11   10   10    9                                       
CONECT    2    7    7    3   10                                       
CONECT    3    4    4    2   12                                       
CONECT    4    5    3    3   13                                       
CONECT    5    8    6    6    4                                       
CONECT    6    5    5    7   14                                       
CONECT    7    6   11    2    2                                       
CONECT    8    5                                                      
CONECT    9    1   15   16                                            
CONECT   10    2    1    1                                            
CONECT   11    7    1                                                 
CONECT   12    3                                                      
CONECT   13    4                                                      
CONECT   14    6                                                      
CONECT   15    9                                                      
CONECT   16    9                                                      
MASTER        0    0    0    0    0    0    0    0   16    0   16    0
END
