COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.616  -0.707  -0.223  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.540   0.321   0.155  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.004  -2.001  -0.237  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.817  -2.118  -0.860  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.073  -1.115  -1.178  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.439   0.273  -0.910  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.230   1.024  -0.414  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.021   0.371  -0.277  1.00  0.00           C  
HETATM    9  C   UNL     1       1.093   1.063   0.180  1.00  0.00           C  
HETATM   10  C   UNL     1       0.989   2.411   0.497  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.222   3.060   0.358  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.331   2.369  -0.103  1.00  0.00           C  
HETATM   13  F   UNL     1      -2.514   3.007  -0.238  1.00  0.00           F  
HETATM   14  N   UNL     1      -2.372  -3.379  -1.174  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.949   0.923  -2.198  1.00  0.00           C  
HETATM   16  N   UNL     1       2.319   0.403   0.320  1.00  0.00           N  
HETATM   17  C   UNL     1       3.469   1.056   0.063  1.00  0.00           C  
HETATM   18  C   UNL     1       4.760   0.331   0.112  1.00  0.00           C  
HETATM   19  O   UNL     1       3.448   2.240  -0.209  1.00  0.00           O  
HETATM   20  N   UNL     1       4.773  -0.965   0.405  1.00  0.00           N  
HETATM   21  C   UNL     1       5.892  -1.651   0.460  1.00  0.00           C  
HETATM   22  C   UNL     1       7.122  -1.033   0.210  1.00  0.00           C  
HETATM   23  C   UNL     1       7.146   0.331  -0.102  1.00  0.00           C  
HETATM   24  C   UNL     1       5.944   1.015  -0.155  1.00  0.00           C  
HETATM   25  C   UNL     1       8.338  -1.786   0.272  1.00  0.00           C  
HETATM   26  N   UNL     1       9.303  -2.382   0.321  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.745  -0.680   0.808  1.00  0.00           C  
HETATM   28  F   UNL     1      -6.705  -1.642   0.475  1.00  0.00           F  
HETATM   29  F   UNL     1      -5.225  -0.959   2.077  1.00  0.00           F  
HETATM   30  F   UNL     1      -6.339   0.587   0.816  1.00  0.00           F  
HETATM   31  H   UNL     1      -5.014  -0.477  -1.212  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.979   1.319   0.186  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.121   0.073   1.130  1.00  0.00           H  
HETATM   34  H   UNL     1       0.058  -0.678  -0.524  1.00  0.00           H  
HETATM   35  H   UNL     1       1.854   2.951   0.852  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.304   4.108   0.605  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.910  -4.154  -0.946  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.520  -3.495  -1.623  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.218   1.960  -2.000  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.166   0.889  -2.956  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.825   0.382  -2.556  1.00  0.00           H  
HETATM   42  H   UNL     1       2.341  -0.525   0.603  1.00  0.00           H  
HETATM   43  H   UNL     1       5.862  -2.703   0.701  1.00  0.00           H  
HETATM   44  H   UNL     1       8.080   0.837  -0.300  1.00  0.00           H  
HETATM   45  H   UNL     1       5.924   2.068  -0.396  1.00  0.00           H  
CONECT    1   27    2    3   31                                       
CONECT    2    1    6   32   33                                       
CONECT    3    1    4                                                 
CONECT    4    3    5    5   14                                       
CONECT    5    6    4    4                                            
CONECT    6    2   15    7    5                                       
CONECT    7   12    6    8    8                                       
CONECT    8    7    7    9   34                                       
CONECT    9   10   10    8   16                                       
CONECT   10   11    9    9   35                                       
CONECT   11   12   12   10   36                                       
CONECT   12   13   11   11    7                                       
CONECT   13   12                                                      
CONECT   14    4   37   38                                            
CONECT   15    6   39   40   41                                       
CONECT   16    9   17   42                                            
CONECT   17   19   19   16   18                                       
CONECT   18   17   24   24   20                                       
CONECT   19   17   17                                                 
CONECT   20   18   21   21                                            
CONECT   21   20   20   22   43                                       
CONECT   22   23   23   21   25                                       
CONECT   23   24   22   22   44                                       
CONECT   24   18   18   23   45                                       
CONECT   25   22   26   26   26                                       
CONECT   26   25   25   25                                            
CONECT   27   28   29   30    1                                       
CONECT   28   27                                                      
CONECT   29   27                                                      
CONECT   30   27                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
