COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.064   0.892   1.412  1.00  0.00           O  
HETATM    2  C   UNL     1       6.667   0.621   0.400  1.00  0.00           C  
HETATM    3  O   UNL     1       7.925   0.159   0.473  1.00  0.00           O  
HETATM    4  C   UNL     1       6.004   0.797  -0.942  1.00  0.00           C  
HETATM    5  C   UNL     1       4.604   1.318  -0.747  1.00  0.00           C  
HETATM    6  C   UNL     1       3.555   0.434  -0.596  1.00  0.00           C  
HETATM    7  C   UNL     1       4.374   2.681  -0.713  1.00  0.00           C  
HETATM    8  C   UNL     1       3.091   3.167  -0.535  1.00  0.00           C  
HETATM    9  C   UNL     1       2.033   2.293  -0.389  1.00  0.00           C  
HETATM   10  C   UNL     1       2.261   0.918  -0.416  1.00  0.00           C  
HETATM   11  C   UNL     1       1.128  -0.027  -0.254  1.00  0.00           C  
HETATM   12  C   UNL     1       1.356  -1.402  -0.276  1.00  0.00           C  
HETATM   13  C   UNL     1       0.300  -2.276  -0.119  1.00  0.00           C  
HETATM   14  C   UNL     1       0.545  -3.763  -0.142  1.00  0.00           C  
HETATM   15  F   UNL     1      -0.402  -4.404   0.664  1.00  0.00           F  
HETATM   16  F   UNL     1       0.434  -4.233  -1.455  1.00  0.00           F  
HETATM   17  F   UNL     1       1.829  -4.032   0.343  1.00  0.00           F  
HETATM   18  C   UNL     1      -0.983  -1.791   0.060  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.166   0.456  -0.073  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.215  -0.427   0.083  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.615   0.095   0.278  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.550  -1.061   0.641  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.095  -1.692   1.958  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.978  -0.532   0.796  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.626   1.125   1.379  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.468   0.680   2.731  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.342   0.327   3.804  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.777   2.446   1.150  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.765   3.287   2.234  1.00  0.00           N  
HETATM   30  C   UNL     1      -3.092   0.757  -0.989  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.452   0.208  -2.159  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.463  -1.263  -2.485  1.00  0.00           C  
HETATM   33  N   UNL     1      -3.804   1.214  -2.993  1.00  0.00           N  
HETATM   34  N   UNL     1      -3.653   2.427  -2.302  1.00  0.00           N  
HETATM   35  C   UNL     1      -3.228   2.158  -1.102  1.00  0.00           C  
HETATM   36  O   UNL     1      -2.938   2.996  -0.070  1.00  0.00           O  
HETATM   37  H   UNL     1       8.306   0.059   1.356  1.00  0.00           H  
HETATM   38  H   UNL     1       6.577   1.506  -1.539  1.00  0.00           H  
HETATM   39  H   UNL     1       5.966  -0.164  -1.456  1.00  0.00           H  
HETATM   40  H   UNL     1       3.736  -0.630  -0.618  1.00  0.00           H  
HETATM   41  H   UNL     1       5.199   3.369  -0.827  1.00  0.00           H  
HETATM   42  H   UNL     1       2.917   4.233  -0.509  1.00  0.00           H  
HETATM   43  H   UNL     1       1.032   2.673  -0.249  1.00  0.00           H  
HETATM   44  H   UNL     1       2.357  -1.782  -0.416  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.806  -2.479   0.183  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.348   1.521  -0.052  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.525  -1.811  -0.150  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.466  -2.715   2.018  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.005  -1.698   2.000  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.487  -1.112   2.793  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.003   0.219   1.586  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.302  -0.082  -0.142  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.644  -1.355   1.054  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.650   2.927   3.127  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.871   4.243   2.107  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.437  -1.684  -2.234  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.272  -1.401  -3.549  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.689  -1.769  -1.908  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.109   1.114  -3.909  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   37                                                 
CONECT    4    2    5   38   39                                       
CONECT    5    6    4    7    7                                       
CONECT    6   10   10    5   40                                       
CONECT    7    5    5    8   41                                       
CONECT    8    9    9    7   42                                       
CONECT    9   10    8    8   43                                       
CONECT   10   11    6    6    9                                       
CONECT   11   12   12   19   10                                       
CONECT   12   13   11   11   44                                       
CONECT   13   14   18   18   12                                       
CONECT   14   15   17   16   13                                       
CONECT   15   14                                                      
CONECT   16   14                                                      
CONECT   17   14                                                      
CONECT   18   13   13   20   45                                       
CONECT   19   20   20   11   46                                       
CONECT   20   18   21   19   19                                       
CONECT   21   25   22   20   30                                       
CONECT   22   23   24   21   47                                       
CONECT   23   22   48   49   50                                       
CONECT   24   22   51   52   53                                       
CONECT   25   26   28   28   21                                       
CONECT   26   27   27   27   25                                       
CONECT   27   26   26   26                                            
CONECT   28   29   25   25   36                                       
CONECT   29   28   54   55                                            
CONECT   30   21   35   31   31                                       
CONECT   31   30   30   32   33                                       
CONECT   32   31   56   57   58                                       
CONECT   33   31   34   59                                            
CONECT   34   35   35   33                                            
CONECT   35   36   30   34   34                                       
CONECT   36   28   35                                                 
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   12                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
