COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -8.474   0.273  -1.661  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.746   0.120  -0.544  1.00  0.00           C  
HETATM    3  O   UNL     1      -8.229   0.377   0.533  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.324  -0.372  -0.633  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.724  -0.456   0.772  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.303  -0.947   0.683  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.269  -0.044   0.546  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.036  -2.304   0.745  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.734  -2.762   0.664  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.692  -1.867   0.521  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.954  -0.500   0.464  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.839   0.466   0.310  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.101   1.833   0.253  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.058   2.729   0.110  1.00  0.00           C  
HETATM   15  F   UNL     1      -0.310   4.055   0.054  1.00  0.00           F  
HETATM   16  C   UNL     1       1.246   2.268   0.024  1.00  0.00           C  
HETATM   17  C   UNL     1       0.475   0.009   0.228  1.00  0.00           C  
HETATM   18  C   UNL     1       1.510   0.911   0.081  1.00  0.00           C  
HETATM   19  C   UNL     1       2.931   0.418  -0.008  1.00  0.00           C  
HETATM   20  C   UNL     1       3.891   1.609  -0.021  1.00  0.00           C  
HETATM   21  C   UNL     1       3.798   2.353   1.312  1.00  0.00           C  
HETATM   22  C   UNL     1       5.322   1.107  -0.226  1.00  0.00           C  
HETATM   23  C   UNL     1       3.236  -0.470   1.172  1.00  0.00           C  
HETATM   24  C   UNL     1       2.883  -0.010   2.481  1.00  0.00           C  
HETATM   25  N   UNL     1       2.603   0.355   3.520  1.00  0.00           N  
HETATM   26  C   UNL     1       3.826  -1.677   1.052  1.00  0.00           C  
HETATM   27  N   UNL     1       4.057  -2.392   2.200  1.00  0.00           N  
HETATM   28  C   UNL     1       3.110  -0.394  -1.266  1.00  0.00           C  
HETATM   29  C   UNL     1       2.752  -0.109  -2.527  1.00  0.00           C  
HETATM   30  C   UNL     1       2.056   1.144  -2.992  1.00  0.00           C  
HETATM   31  N   UNL     1       3.128  -1.150  -3.305  1.00  0.00           N  
HETATM   32  N   UNL     1       3.741  -2.110  -2.484  1.00  0.00           N  
HETATM   33  C   UNL     1       3.731  -1.662  -1.262  1.00  0.00           C  
HETATM   34  O   UNL     1       4.203  -2.230  -0.118  1.00  0.00           O  
HETATM   35  H   UNL     1      -9.381   0.591  -1.554  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.309  -1.359  -1.094  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.737   0.320  -1.238  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.739   0.532   1.233  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.311  -1.147   1.377  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.477   1.015   0.501  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.848  -3.007   0.857  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.531  -3.822   0.713  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.675  -2.226   0.459  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.118   2.192   0.319  1.00  0.00           H  
HETATM   45  H   UNL     1       2.059   2.970  -0.087  1.00  0.00           H  
HETATM   46  H   UNL     1       0.683  -1.049   0.277  1.00  0.00           H  
HETATM   47  H   UNL     1       3.623   2.283  -0.834  1.00  0.00           H  
HETATM   48  H   UNL     1       4.195   1.724   2.109  1.00  0.00           H  
HETATM   49  H   UNL     1       4.377   3.275   1.255  1.00  0.00           H  
HETATM   50  H   UNL     1       2.755   2.592   1.523  1.00  0.00           H  
HETATM   51  H   UNL     1       5.389   0.577  -1.176  1.00  0.00           H  
HETATM   52  H   UNL     1       6.006   1.956  -0.235  1.00  0.00           H  
HETATM   53  H   UNL     1       5.591   0.433   0.587  1.00  0.00           H  
HETATM   54  H   UNL     1       3.798  -2.026   3.060  1.00  0.00           H  
HETATM   55  H   UNL     1       4.479  -3.264   2.152  1.00  0.00           H  
HETATM   56  H   UNL     1       2.800   1.894  -3.263  1.00  0.00           H  
HETATM   57  H   UNL     1       1.439   0.916  -3.861  1.00  0.00           H  
HETATM   58  H   UNL     1       1.427   1.530  -2.191  1.00  0.00           H  
HETATM   59  H   UNL     1       2.997  -1.221  -4.264  1.00  0.00           H  
CONECT    1    2   35                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    5    2   36   37                                       
CONECT    5    6    4   38   39                                       
CONECT    6    8    5    7    7                                       
CONECT    7    6    6   11   40                                       
CONECT    8    9    9    6   41                                       
CONECT    9    8    8   10   42                                       
CONECT   10    9   11   11   43                                       
CONECT   11   10   10    7   12                                       
CONECT   12   11   17   17   13                                       
CONECT   13   12   14   14   44                                       
CONECT   14   13   13   16   15                                       
CONECT   15   14                                                      
CONECT   16   18   18   14   45                                       
CONECT   17   12   12   18   46                                       
CONECT   18   17   19   16   16                                       
CONECT   19   28   18   20   23                                       
CONECT   20   19   22   21   47                                       
CONECT   21   20   48   49   50                                       
CONECT   22   20   51   52   53                                       
CONECT   23   19   26   26   24                                       
CONECT   24   23   25   25   25                                       
CONECT   25   24   24   24                                            
CONECT   26   34   23   23   27                                       
CONECT   27   26   54   55                                            
CONECT   28   29   29   33   19                                       
CONECT   29   31   30   28   28                                       
CONECT   30   29   56   57   58                                       
CONECT   31   32   29   59                                            
CONECT   32   31   33   33                                            
CONECT   33   32   32   28   34                                       
CONECT   34   33   26                                                 
CONECT   35    1                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
