COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.062  -0.078  -0.151  1.00  0.00           C  
HETATM    2  C   UNL     1       3.368  -7.386   1.651  1.00  0.00           C  
HETATM    3  C   UNL     1       3.880  -6.368   0.630  1.00  0.00           C  
HETATM    4  C   UNL     1       3.392  -2.563   0.685  1.00  0.00           C  
HETATM    5  C   UNL     1       3.372   0.340   0.113  1.00  0.00           C  
HETATM    6  C   UNL     1       2.662  -1.906  -0.490  1.00  0.00           C  
HETATM    7  C   UNL     1       3.552  -1.961  -1.734  1.00  0.00           C  
HETATM    8  C   UNL     1       3.837  -3.420  -2.096  1.00  0.00           C  
HETATM    9  C   UNL     1       4.581  -4.094  -0.938  1.00  0.00           C  
HETATM   10  C   UNL     1       3.457  -4.983   1.046  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.190  -0.486  -0.408  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.540  -0.992  -0.575  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.495  -1.500  -1.447  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.816  -1.121  -1.320  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.852  -1.671  -2.265  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.190  -0.232  -0.320  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.059  -0.216   1.129  1.00  0.00           C  
HETATM   18  C   UNL     1      -9.543   0.149   1.201  1.00  0.00           C  
HETATM   19  C   UNL     1     -11.110   1.993   1.090  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.175   1.957  -0.366  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.690   1.593  -0.437  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.235   0.275   0.551  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.914  -0.104   0.424  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.587   1.665   0.170  1.00  0.00           C  
HETATM   25  C   UNL     1       0.758   1.265   0.163  1.00  0.00           C  
HETATM   26  C   UNL     1       1.795   2.178   0.463  1.00  0.00           C  
HETATM   27  C   UNL     1       1.478   3.612   0.799  1.00  0.00           C  
HETATM   28  C   UNL     1       3.092   1.738   0.443  1.00  0.00           C  
HETATM   29  C   UNL     1       4.201   2.670   0.753  1.00  0.00           C  
HETATM   30  C   UNL     1       5.010   3.162  -0.272  1.00  0.00           C  
HETATM   31  C   UNL     1       6.044   4.032   0.024  1.00  0.00           C  
HETATM   32  C   UNL     1       6.276   4.413   1.336  1.00  0.00           C  
HETATM   33  C   UNL     1       5.476   3.927   2.355  1.00  0.00           C  
HETATM   34  C   UNL     1       4.438   3.064   2.070  1.00  0.00           C  
HETATM   35  F   UNL     1       6.829   4.509  -0.966  1.00  0.00           F  
HETATM   36  N   UNL     1       2.364  -0.510  -0.163  1.00  0.00           N  
HETATM   37  N   UNL     1       3.797  -3.919   0.292  1.00  0.00           N  
HETATM   38  N   UNL     1       0.064  -0.910  -0.427  1.00  0.00           N  
HETATM   39  N   UNL     1      -2.200  -1.381  -0.701  1.00  0.00           N  
HETATM   40  N   UNL     1      -7.530   0.153  -0.192  1.00  0.00           N  
HETATM   41  N   UNL     1      -9.704   1.589   0.955  1.00  0.00           N  
HETATM   42  N   UNL     1      -1.513   0.770  -0.117  1.00  0.00           N  
HETATM   43  O   UNL     1       4.524  -0.058   0.089  1.00  0.00           O  
HETATM   44  O   UNL     1       2.810  -4.826   2.060  1.00  0.00           O  
HETATM   45 CL   UNL     1       4.720   2.683  -1.915  1.00  0.00          Cl  
HETATM   46  H   UNL     1       3.674  -8.388   1.350  1.00  0.00           H  
HETATM   47  H   UNL     1       3.786  -7.158   2.632  1.00  0.00           H  
HETATM   48  H   UNL     1       2.280  -7.338   1.699  1.00  0.00           H  
HETATM   49  H   UNL     1       4.968  -6.417   0.582  1.00  0.00           H  
HETATM   50  H   UNL     1       3.463  -6.596  -0.351  1.00  0.00           H  
HETATM   51  H   UNL     1       4.275  -1.977   0.940  1.00  0.00           H  
HETATM   52  H   UNL     1       2.728  -2.615   1.548  1.00  0.00           H  
HETATM   53  H   UNL     1       1.732  -2.441  -0.685  1.00  0.00           H  
HETATM   54  H   UNL     1       3.045  -1.473  -2.566  1.00  0.00           H  
HETATM   55  H   UNL     1       4.492  -1.448  -1.530  1.00  0.00           H  
HETATM   56  H   UNL     1       2.896  -3.941  -2.276  1.00  0.00           H  
HETATM   57  H   UNL     1       4.451  -3.459  -2.995  1.00  0.00           H  
HETATM   58  H   UNL     1       4.698  -5.157  -1.149  1.00  0.00           H  
HETATM   59  H   UNL     1       5.562  -3.635  -0.818  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.203  -2.190  -2.224  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.266  -2.592  -1.854  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.650  -0.940  -2.396  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.390  -1.880  -3.230  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.514   0.325   1.903  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.940  -1.288   1.282  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.093  -0.412   0.444  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.931  -0.097   2.189  1.00  0.00           H  
HETATM   68  H   UNL     1     -11.457   1.770   2.099  1.00  0.00           H  
HETATM   69  H   UNL     1     -11.200   3.063   0.903  1.00  0.00           H  
HETATM   70  H   UNL     1     -11.716   1.446   0.368  1.00  0.00           H  
HETATM   71  H   UNL     1      -9.293   3.030  -0.519  1.00  0.00           H  
HETATM   72  H   UNL     1      -9.720   1.417  -1.140  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.302   1.839  -1.426  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.141   2.154   0.319  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.527   0.967   1.328  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.171   0.290   1.102  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.858   2.683   0.406  1.00  0.00           H  
HETATM   78  H   UNL     1       0.400   3.764   0.762  1.00  0.00           H  
HETATM   79  H   UNL     1       1.844   3.839   1.801  1.00  0.00           H  
HETATM   80  H   UNL     1       1.963   4.270   0.078  1.00  0.00           H  
HETATM   81  H   UNL     1       7.084   5.091   1.564  1.00  0.00           H  
HETATM   82  H   UNL     1       5.662   4.227   3.375  1.00  0.00           H  
HETATM   83  H   UNL     1       3.815   2.686   2.867  1.00  0.00           H  
HETATM   84  H   UNL     1      -1.981  -2.280  -0.994  1.00  0.00           H  
CONECT    1   25   36   38   38                                       
CONECT    2    3   46   47   48                                       
CONECT    3    2   10   49   50                                       
CONECT    4    6   37   51   52                                       
CONECT    5   28   43   43   36                                       
CONECT    6   36    4    7   53                                       
CONECT    7    6    8   54   55                                       
CONECT    8    7    9   56   57                                       
CONECT    9   37    8   58   59                                       
CONECT   10   37    3   44   44                                       
CONECT   11   42   42   38   39                                       
CONECT   12   39   23   23   13                                       
CONECT   13   12   14   14   60                                       
CONECT   14   13   13   16   15                                       
CONECT   15   14   61   62   63                                       
CONECT   16   22   22   14   40                                       
CONECT   17   40   18   64   65                                       
CONECT   18   17   41   66   67                                       
CONECT   19   41   68   69   70                                       
CONECT   20   41   21   71   72                                       
CONECT   21   40   20   73   74                                       
CONECT   22   23   16   16   75                                       
CONECT   23   12   12   22   76                                       
CONECT   24   25   25   42   77                                       
CONECT   25   26   24   24    1                                       
CONECT   26   27   28   28   25                                       
CONECT   27   26   78   79   80                                       
CONECT   28   29   26   26    5                                       
CONECT   29   30   30   34   28                                       
CONECT   30   31   45   29   29                                       
CONECT   31   35   32   32   30                                       
CONECT   32   31   31   33   81                                       
CONECT   33   32   34   34   82                                       
CONECT   34   33   33   29   83                                       
CONECT   35   31                                                      
CONECT   36    5    6    1                                            
CONECT   37    4    9   10                                            
CONECT   38    1    1   11                                            
CONECT   39   11   12   84                                            
CONECT   40   16   17   21                                            
CONECT   41   18   19   20                                            
CONECT   42   24   11   11                                            
CONECT   43    5    5                                                 
CONECT   44   10   10                                                 
CONECT   45   30                                                      
CONECT   46    2                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    3                                                      
CONECT   51    4                                                      
CONECT   52    4                                                      
CONECT   53    6                                                      
CONECT   54    7                                                      
CONECT   55    7                                                      
CONECT   56    8                                                      
CONECT   57    8                                                      
CONECT   58    9                                                      
CONECT   59    9                                                      
CONECT   60   13                                                      
CONECT   61   15                                                      
CONECT   62   15                                                      
CONECT   63   15                                                      
CONECT   64   17                                                      
CONECT   65   17                                                      
CONECT   66   18                                                      
CONECT   67   18                                                      
CONECT   68   19                                                      
CONECT   69   19                                                      
CONECT   70   19                                                      
CONECT   71   20                                                      
CONECT   72   20                                                      
CONECT   73   21                                                      
CONECT   74   21                                                      
CONECT   75   22                                                      
CONECT   76   23                                                      
CONECT   77   24                                                      
CONECT   78   27                                                      
CONECT   79   27                                                      
CONECT   80   27                                                      
CONECT   81   32                                                      
CONECT   82   33                                                      
CONECT   83   34                                                      
CONECT   84   39                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
