COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.911  -2.205  -1.622  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.037  -1.565  -1.017  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.825  -0.349  -0.456  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.622   0.177  -0.492  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.363   1.372   0.045  1.00  0.00           C  
HETATM    6  C   UNL     1       0.933   1.927   0.001  1.00  0.00           C  
HETATM    7  N   UNL     1       2.148   1.510  -0.514  1.00  0.00           N  
HETATM    8  C   UNL     1       2.384   0.300  -1.183  1.00  0.00           C  
HETATM    9  C   UNL     1       2.239   0.227  -2.561  1.00  0.00           C  
HETATM   10  C   UNL     1       2.472  -0.966  -3.218  1.00  0.00           C  
HETATM   11  C   UNL     1       2.849  -2.089  -2.505  1.00  0.00           C  
HETATM   12  C   UNL     1       2.995  -2.025  -1.132  1.00  0.00           C  
HETATM   13  C   UNL     1       2.770  -0.831  -0.467  1.00  0.00           C  
HETATM   14  O   UNL     1       2.919  -0.764   0.883  1.00  0.00           O  
HETATM   15  C   UNL     1       3.317  -1.963   1.552  1.00  0.00           C  
HETATM   16  F   UNL     1       4.556  -2.384   1.057  1.00  0.00           F  
HETATM   17  F   UNL     1       3.422  -1.718   2.925  1.00  0.00           F  
HETATM   18  F   UNL     1       2.362  -2.961   1.328  1.00  0.00           F  
HETATM   19  C   UNL     1       3.066   2.463  -0.263  1.00  0.00           C  
HETATM   20  O   UNL     1       4.239   2.412  -0.583  1.00  0.00           O  
HETATM   21  N   UNL     1       2.484   3.484   0.397  1.00  0.00           N  
HETATM   22  C   UNL     1       1.139   3.175   0.578  1.00  0.00           C  
HETATM   23  C   UNL     1       0.070   3.840   1.181  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.130   3.311   1.214  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.391   2.114   0.677  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.688   1.570   0.727  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.902   0.330   0.149  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.253  -0.282   0.172  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.294  -0.153  -0.791  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.250   0.647  -2.068  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.289  -0.864  -0.350  1.00  0.00           N  
HETATM   32  O   UNL     1      -6.032  -1.395   0.705  1.00  0.00           O  
HETATM   33  C   UNL     1      -4.791  -1.107   1.120  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.122  -1.592   2.380  1.00  0.00           C  
HETATM   35  H   UNL     1      -0.135  -2.359  -0.873  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.218  -3.168  -2.031  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.523  -1.577  -2.424  1.00  0.00           H  
HETATM   38  H   UNL     1       1.944   1.103  -3.119  1.00  0.00           H  
HETATM   39  H   UNL     1       2.359  -1.021  -4.291  1.00  0.00           H  
HETATM   40  H   UNL     1       3.030  -3.020  -3.023  1.00  0.00           H  
HETATM   41  H   UNL     1       3.289  -2.905  -0.579  1.00  0.00           H  
HETATM   42  H   UNL     1       2.926   4.294   0.694  1.00  0.00           H  
HETATM   43  H   UNL     1       0.234   4.809   1.628  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.496   2.107   1.201  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.877   0.019  -2.877  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.253   0.996  -2.312  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.588   1.503  -1.938  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.323  -0.892   3.191  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.514  -2.575   2.644  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.047  -1.662   2.217  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3                                                 
CONECT    3    2    4   27   27                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4    6   25                                       
CONECT    6    5    7   22   22                                       
CONECT    7    6    8   19                                            
CONECT    8    7    9   13   13                                       
CONECT    9    8   10   10   38                                       
CONECT   10    9    9   11   39                                       
CONECT   11   10   12   12   40                                       
CONECT   12   11   11   13   41                                       
CONECT   13    8    8   12   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   17   18                                       
CONECT   16   15                                                      
CONECT   17   15                                                      
CONECT   18   15                                                      
CONECT   19    7   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   42                                            
CONECT   22    6    6   21   23                                       
CONECT   23   22   24   24   43                                       
CONECT   24   23   23   25                                            
CONECT   25    5   24   26   26                                       
CONECT   26   25   25   27   44                                       
CONECT   27    3    3   26   28                                       
CONECT   28   27   29   33   33                                       
CONECT   29   28   30   31   31                                       
CONECT   30   29   45   46   47                                       
CONECT   31   29   29   32                                            
CONECT   32   31   33                                                 
CONECT   33   28   28   32   34                                       
CONECT   34   33   48   49   50                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   26                                                      
CONECT   45   30                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
CONECT   48   34                                                      
CONECT   49   34                                                      
CONECT   50   34                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
