COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.426  -5.390   1.112  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.523  -5.112  -0.389  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.613  -3.603  -0.624  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.504  -2.956   0.005  1.00  0.00           O  
HETATM    5  N   UNL     1      -3.493  -1.549  -0.153  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.501  -0.817   0.392  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.615  -1.367   1.020  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.490   0.590   0.233  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.591   1.453   0.825  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.971   2.796   0.372  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.484   4.082   0.595  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.065   5.117   0.024  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.115   4.985  -0.770  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.660   3.748  -1.044  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.087   2.615  -0.468  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.356   1.300  -0.527  1.00  0.00           O  
HETATM   17  N   UNL     1      -0.546   1.121   1.672  1.00  0.00           N  
HETATM   18  C   UNL     1       0.690   0.738   1.141  1.00  0.00           C  
HETATM   19  C   UNL     1       0.840   0.581  -0.231  1.00  0.00           C  
HETATM   20  C   UNL     1       2.061   0.203  -0.753  1.00  0.00           C  
HETATM   21  C   UNL     1       3.137  -0.018   0.089  1.00  0.00           C  
HETATM   22  C   UNL     1       2.993   0.137   1.456  1.00  0.00           C  
HETATM   23  C   UNL     1       1.774   0.521   1.985  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.362  -5.628  -1.044  1.00  0.00           O  
HETATM   25  F   UNL     1      -4.733   3.636  -1.858  1.00  0.00           F  
HETATM   26  F   UNL     1       1.635   0.679   3.319  1.00  0.00           F  
HETATM   27  I   UNL     1       4.987  -0.591  -0.709  1.00  0.00           I  
HETATM   28  H   UNL     1      -5.311  -4.997   1.612  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.362  -6.465   1.280  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.536  -4.906   1.515  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.413  -5.596  -0.792  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.592  -3.400  -1.695  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.543  -3.224  -0.200  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.200  -1.112  -0.654  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.629   4.231   1.237  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.555   5.866  -1.214  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.672   1.153   2.633  1.00  0.00           H  
HETATM   38  H   UNL     1       0.001   0.753  -0.889  1.00  0.00           H  
HETATM   39  H   UNL     1       2.177   0.080  -1.819  1.00  0.00           H  
HETATM   40  H   UNL     1       3.834  -0.038   2.111  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.241  -6.581  -0.938  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2   24    1    3   31                                       
CONECT    3    2    4   32   33                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   34                                            
CONECT    6    7    7    5    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9    9   16                                       
CONECT    9    8    8   17   10                                       
CONECT   10    9   15   15   11                                       
CONECT   11   10   12   12   35                                       
CONECT   12   11   11   13                                            
CONECT   13   14   14   12   36                                       
CONECT   14   15   25   13   13                                       
CONECT   15   16   10   10   14                                       
CONECT   16    8   15                                                 
CONECT   17    9   18   37                                            
CONECT   18   17   23   23   19                                       
CONECT   19   18   20   20   38                                       
CONECT   20   19   19   21   39                                       
CONECT   21   22   22   20   27                                       
CONECT   22   23   21   21   40                                       
CONECT   23   26   18   18   22                                       
CONECT   24    2   41                                                 
CONECT   25   14                                                      
CONECT   26   23                                                      
CONECT   27   21                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   24                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
