COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      17.614   3.524  46.033  1.00  0.00           O1+
HETATM    2  C   UNL     1      17.056   3.854  45.075  1.00  0.00           C  
HETATM    3 FE   UNL     1      16.360   4.432  43.564  1.00  0.00          Fe  
HETATM    4  C   UNL     1      16.469   6.178  44.201  1.00  0.00           C  
HETATM    5  O   UNL     1      16.307   6.976  45.066  1.00  0.00           O  
HETATM    6  C   UNL     1      14.536   4.479  44.146  1.00  0.00           C  
HETATM    7  N   UNL     1      13.521   4.437  44.643  1.00  0.00           N  
HETATM    8  S   UNL     1      18.486   4.496  42.560  1.00  0.00           S  
HETATM    9  S   UNL     1      15.487   5.134  41.506  1.00  0.00           S  
HETATM   10 FE   UNL     1      17.197   6.472  42.223  1.00  0.00          Fe  
HETATM   11  C   UNL     1      16.155   7.842  42.232  1.00  0.00           C  
HETATM   12  O   UNL     1      15.459   8.787  41.982  1.00  0.00           O1+
HETATM   13  C   UNL     1      18.609   7.303  43.070  1.00  0.00           C  
HETATM   14  N   UNL     1      19.519   7.894  43.617  1.00  0.00           N  
HETATM   15  C   UNL     1      16.237   3.886  40.276  1.00  0.00           C  
HETATM   16  S   UNL     1      16.948   2.612  40.753  1.00  0.00           S  
HETATM   17  C   UNL     1      18.250   3.259  41.180  1.00  0.00           C  
HETATM   18  H   UNL     1      15.412   3.556  39.628  1.00  0.00           H  
HETATM   19  H   UNL     1      16.972   4.445  39.678  1.00  0.00           H  
HETATM   20  H   UNL     1      18.625   3.764  40.278  1.00  0.00           H  
HETATM   21  H   UNL     1      18.915   2.420  41.434  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    1    1    1    3                                       
CONECT    3    2    4    6    8                                       
CONECT    3    9                                                      
CONECT    4    3    5    5   10                                       
CONECT    5    4    4                                                 
CONECT    6    3    7    7    7                                       
CONECT    7    6    6    6                                            
CONECT    8    3   10   17                                            
CONECT    9    3   10   15                                            
CONECT   10    4    8    9   11                                       
CONECT   10   13                                                      
CONECT   11   10   12   12   12                                       
CONECT   12   11   11   11                                            
CONECT   13   10   14   14   14                                       
CONECT   14   13   13   13                                            
CONECT   15    9   16   18   19                                       
CONECT   16   15   17                                                 
CONECT   17    8   16   20   21                                       
CONECT   18   15                                                      
CONECT   19   15                                                      
CONECT   20   17                                                      
CONECT   21   17                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
