COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.074  -0.588   0.592  1.00  0.00           C  
HETATM    2  O   UNL     1       7.234   0.236   0.460  1.00  0.00           O  
HETATM    3  C   UNL     1       7.173   1.423   1.259  1.00  0.00           C  
HETATM    4  C   UNL     1       6.092   2.341   0.681  1.00  0.00           C  
HETATM    5  C   UNL     1       4.836   1.550   0.438  1.00  0.00           C  
HETATM    6  C   UNL     1       4.832   0.233   0.395  1.00  0.00           C  
HETATM    7  C   UNL     1       3.554  -0.463   0.142  1.00  0.00           C  
HETATM    8  C   UNL     1       2.388   0.279  -0.050  1.00  0.00           C  
HETATM    9  N   UNL     1       3.525  -1.791   0.094  1.00  0.00           N  
HETATM   10  C   UNL     1       2.408  -2.452  -0.129  1.00  0.00           C  
HETATM   11  F   UNL     1       2.427  -3.802  -0.169  1.00  0.00           F  
HETATM   12  C   UNL     1       1.206  -1.775  -0.325  1.00  0.00           C  
HETATM   13  O   UNL     1       0.068  -2.469  -0.555  1.00  0.00           O  
HETATM   14  C   UNL     1       1.199  -0.386  -0.286  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.072   0.375  -0.493  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.150   1.569   0.481  1.00  0.00           C  
HETATM   17  O   UNL     1       0.363   2.638  -0.342  1.00  0.00           O  
HETATM   18  C   UNL     1       0.163   2.297  -1.631  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.083   1.033  -1.807  1.00  0.00           N  
HETATM   20  N   UNL     1       0.215   3.202  -2.663  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.275  -0.507  -0.330  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.519   0.062  -0.140  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.143  -1.890  -0.364  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.265  -2.698  -0.210  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.508  -2.134  -0.024  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.642  -0.746   0.014  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.978  -0.133   0.218  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.068  -0.532  -0.559  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.294   0.071  -0.330  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.400   1.038   0.651  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.353   1.396   1.371  1.00  0.00           N  
HETATM   32  C   UNL     1      -5.167   0.847   1.194  1.00  0.00           C  
HETATM   33  F   UNL     1      -4.124   1.245   1.955  1.00  0.00           F  
HETATM   34  H   UNL     1       6.106  -1.380  -0.156  1.00  0.00           H  
HETATM   35  H   UNL     1       6.059  -1.034   1.587  1.00  0.00           H  
HETATM   36  H   UNL     1       6.921   1.161   2.286  1.00  0.00           H  
HETATM   37  H   UNL     1       8.137   1.932   1.233  1.00  0.00           H  
HETATM   38  H   UNL     1       5.883   3.145   1.387  1.00  0.00           H  
HETATM   39  H   UNL     1       6.441   2.766  -0.260  1.00  0.00           H  
HETATM   40  H   UNL     1       3.906   2.079   0.294  1.00  0.00           H  
HETATM   41  H   UNL     1       2.414   1.358  -0.015  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.181   1.764   0.780  1.00  0.00           H  
HETATM   43  H   UNL     1       0.483   1.405   1.353  1.00  0.00           H  
HETATM   44  H   UNL     1       0.064   2.907  -3.574  1.00  0.00           H  
HETATM   45  H   UNL     1       0.403   4.135  -2.480  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.620   1.137  -0.110  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.162  -3.772  -0.236  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.377  -2.765   0.094  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.958  -1.290  -1.320  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.158  -0.213  -0.912  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.355   1.510   0.831  1.00  0.00           H  
CONECT    1    6    2   34   35                                       
CONECT    2    1    3                                                 
CONECT    3    2    4   36   37                                       
CONECT    4    3    5   38   39                                       
CONECT    5    6    6    4   40                                       
CONECT    6    7    1    5    5                                       
CONECT    7    8    6    9    9                                       
CONECT    8   14   14    7   41                                       
CONECT    9    7    7   10                                            
CONECT   10   12   12    9   11                                       
CONECT   11   10                                                      
CONECT   12   14   13   10   10                                       
CONECT   13   23   12                                                 
CONECT   14   15    8    8   12                                       
CONECT   15   19   21   16   14                                       
CONECT   16   17   15   42   43                                       
CONECT   17   18   16                                                 
CONECT   18   20   19   19   17                                       
CONECT   19   18   18   15                                            
CONECT   20   18   44   45                                            
CONECT   21   22   15   23   23                                       
CONECT   22   26   26   21   46                                       
CONECT   23   21   21   24   13                                       
CONECT   24   25   25   23   47                                       
CONECT   25   26   24   24   48                                       
CONECT   26   27   22   22   25                                       
CONECT   27   32   32   28   26                                       
CONECT   28   29   29   27   49                                       
CONECT   29   30   28   28   50                                       
CONECT   30   31   31   29   51                                       
CONECT   31   30   30   32                                            
CONECT   32   31   33   27   27                                       
CONECT   33   32                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    8                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
