COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.309  -0.983   0.501  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.775   0.015   0.374  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.106   0.535   0.113  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.099  -0.402   0.230  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.479   1.379   0.403  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.494   2.305   0.285  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.805   1.885   0.138  1.00  0.00           C  
HETATM    8  C   UNL     1       4.008   1.245  -0.428  1.00  0.00           C  
HETATM    9  C   UNL     1       4.623   2.475  -0.271  1.00  0.00           C  
HETATM   10  C   UNL     1       5.909   2.546   0.230  1.00  0.00           C  
HETATM   11  C   UNL     1       6.582   1.388   0.575  1.00  0.00           C  
HETATM   12  C   UNL     1       5.968   0.159   0.419  1.00  0.00           C  
HETATM   13  C   UNL     1       4.683   0.086  -0.082  1.00  0.00           C  
HETATM   14  F   UNL     1       2.749   1.175  -0.913  1.00  0.00           F  
HETATM   15  I   UNL     1      -5.094  -0.089  -0.104  1.00  0.00           I  
HETATM   16  N   UNL     1       2.613  -1.521   0.760  1.00  0.00           N  
HETATM   17  N   UNL     1       1.586  -0.576   0.640  1.00  0.00           N  
HETATM   18  O   UNL     1       0.047  -2.169   0.485  1.00  0.00           O  
HETATM   19  O   UNL     1       3.358  -1.496  -1.593  1.00  0.00           O  
HETATM   20  O   UNL     1       4.826  -2.453   0.190  1.00  0.00           O  
HETATM   21  S   UNL     1       3.901  -1.481  -0.280  1.00  0.00           S  
HETATM   22  H   UNL     1      -2.335  -1.456   0.211  1.00  0.00           H  
HETATM   23  H   UNL     1       0.543   1.709   0.519  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.266   3.361   0.308  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.596   2.614   0.046  1.00  0.00           H  
HETATM   26  H   UNL     1       4.098   3.379  -0.541  1.00  0.00           H  
HETATM   27  H   UNL     1       6.389   3.505   0.352  1.00  0.00           H  
HETATM   28  H   UNL     1       7.587   1.444   0.966  1.00  0.00           H  
HETATM   29  H   UNL     1       6.495  -0.745   0.689  1.00  0.00           H  
HETATM   30  H   UNL     1       2.569  -2.200   1.452  1.00  0.00           H  
HETATM   31  H   UNL     1       1.795   0.371   0.656  1.00  0.00           H  
CONECT    1   18   18    2   17                                       
CONECT    2    5    1    4    4                                       
CONECT    3    7    7    4   15                                       
CONECT    4    2    2    3   22                                       
CONECT    5    6    6    2   23                                       
CONECT    6    5    5    7   24                                       
CONECT    7    6    3    3   25                                       
CONECT    8   13   14    9    9                                       
CONECT    9    8    8   10   26                                       
CONECT   10   11   11    9   27                                       
CONECT   11   12   10   10   28                                       
CONECT   12   13   13   11   29                                       
CONECT   13   21   12   12    8                                       
CONECT   14    8                                                      
CONECT   15    3                                                      
CONECT   16   17   21   30                                            
CONECT   17    1   16   31                                            
CONECT   18    1    1                                                 
CONECT   19   21   21                                                 
CONECT   20   21   21                                                 
CONECT   21   16   19   19   20                                       
CONECT   21   20   13                                                 
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
