COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.896   1.655  -1.196  1.00  0.00           C  
HETATM    2  C   UNL     1       7.517   1.676   0.033  1.00  0.00           C  
HETATM    3  C   UNL     1       1.075   1.869  -0.315  1.00  0.00           C  
HETATM    4  C   UNL     1       4.919   1.062   2.428  1.00  0.00           C  
HETATM    5  C   UNL     1       0.571   0.571  -0.462  1.00  0.00           C  
HETATM    6  C   UNL     1       5.392   1.235   1.108  1.00  0.00           C  
HETATM    7  C   UNL     1       4.767   1.228  -0.158  1.00  0.00           C  
HETATM    8  C   UNL     1       3.311   0.986  -0.269  1.00  0.00           C  
HETATM    9  C   UNL     1       5.531   1.433  -1.297  1.00  0.00           C  
HETATM   10  C   UNL     1       1.458  -0.532  -0.513  1.00  0.00           C  
HETATM   11  C   UNL     1       6.777   1.467   1.194  1.00  0.00           C  
HETATM   12  C   UNL     1       2.838  -0.311  -0.415  1.00  0.00           C  
HETATM   13  C   UNL     1       2.419   2.070  -0.227  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.820   0.317  -0.563  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.354  -1.944  -0.745  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.419   1.963   1.741  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.168   1.630   0.926  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.391   2.893   0.659  1.00  0.00           C  
HETATM   19  C   UNL     1       0.394  -4.774   0.488  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.400  -5.406  -1.792  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.347   2.707  -1.764  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.489   2.474   0.766  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.903  -5.352   1.061  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.674  -5.966  -1.153  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.255   3.847  -0.486  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.473   1.760  -0.691  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.489   1.437  -1.774  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.624   1.215   0.639  1.00  0.00           C  
HETATM   29  C   UNL     1       0.135  -4.259  -0.930  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.257   2.683  -0.538  1.00  0.00           C  
HETATM   31  C   UNL     1       4.874   1.414  -2.653  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.122  -7.816   2.089  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.539  -7.115   0.794  1.00  0.00           C  
HETATM   34  N   UNL     1       5.924   1.177   3.249  1.00  0.00           N  
HETATM   35  N   UNL     1       0.948  -1.766  -0.655  1.00  0.00           N  
HETATM   36  N   UNL     1      -1.222  -0.938  -0.701  1.00  0.00           N  
HETATM   37  N   UNL     1       7.097   1.429   2.528  1.00  0.00           N  
HETATM   38  N   UNL     1      -6.244   2.842  -0.047  1.00  0.00           N  
HETATM   39  N   UNL     1      -1.373  -6.446   0.202  1.00  0.00           N  
HETATM   40  N   UNL     1      -1.732   1.350  -0.519  1.00  0.00           N  
HETATM   41  O   UNL     1      -7.798   3.956   1.079  1.00  0.00           O  
HETATM   42  O   UNL     1      -0.828  -3.204  -0.887  1.00  0.00           O  
HETATM   43  F   UNL     1       3.700  -1.350  -0.456  1.00  0.00           F  
HETATM   44 CL   UNL     1       3.036   3.682  -0.043  1.00  0.00          Cl  
HETATM   45  H   UNL     1       7.479   1.817  -2.091  1.00  0.00           H  
HETATM   46  H   UNL     1       8.580   1.854   0.097  1.00  0.00           H  
HETATM   47  H   UNL     1       0.399   2.711  -0.275  1.00  0.00           H  
HETATM   48  H   UNL     1       3.895   0.866   2.710  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.042   2.661   1.182  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.981   1.049   1.935  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.126   2.417   2.688  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.545   0.932   1.485  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.461   1.176  -0.021  1.00  0.00           H  
HETATM   54  H   UNL     1       0.734  -3.952   1.118  1.00  0.00           H  
HETATM   55  H   UNL     1       1.157  -5.551   0.460  1.00  0.00           H  
HETATM   56  H   UNL     1       0.351  -6.194  -1.856  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.626  -5.036  -2.792  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.701   3.583  -1.722  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.954   2.744  -2.669  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.194   2.351   1.588  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.851   3.337   0.956  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.718  -5.733   2.065  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.662  -4.571   1.102  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.429  -5.181  -1.101  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.050  -6.792  -1.756  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.020   4.594   0.272  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.473   4.282  -1.461  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.756   1.574  -1.727  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.411   0.848  -0.097  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.134   0.564  -1.871  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.797   1.473  -2.615  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.029   1.090   1.544  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.267   0.345   0.503  1.00  0.00           H  
HETATM   74  H   UNL     1       1.066  -3.886  -1.358  1.00  0.00           H  
HETATM   75  H   UNL     1       4.885   0.399  -3.048  1.00  0.00           H  
HETATM   76  H   UNL     1       3.843   1.758  -2.562  1.00  0.00           H  
HETATM   77  H   UNL     1       5.418   2.074  -3.329  1.00  0.00           H  
HETATM   78  H   UNL     1      -1.351  -8.554   1.870  1.00  0.00           H  
HETATM   79  H   UNL     1      -1.731  -7.079   2.791  1.00  0.00           H  
HETATM   80  H   UNL     1      -2.987  -8.312   2.528  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.931  -7.852   0.092  1.00  0.00           H  
HETATM   82  H   UNL     1      -3.310  -6.377   1.013  1.00  0.00           H  
HETATM   83  H   UNL     1       7.982   1.555   2.905  1.00  0.00           H  
CONECT    1    9    2    2   45                                       
CONECT    2    1    1   11   46                                       
CONECT    3   13   13    5   47                                       
CONECT    4    6   34   34   48                                       
CONECT    5   10   10    3   14                                       
CONECT    6    7   11   11    4                                       
CONECT    7    9    9    8    6                                       
CONECT    8    7   12   12   13                                       
CONECT    9   31    1    7    7                                       
CONECT   10   12   35    5    5                                       
CONECT   11    2    6    6   37                                       
CONECT   12   43    8    8   10                                       
CONECT   13    8   44    3    3                                       
CONECT   14    5   36   36   40                                       
CONECT   15   35   35   42   36                                       
CONECT   16   17   49   50   51                                       
CONECT   17   18   16   52   53                                       
CONECT   18   41   41   38   17                                       
CONECT   19   23   29   54   55                                       
CONECT   20   24   29   56   57                                       
CONECT   21   30   27   58   59                                       
CONECT   22   28   30   60   61                                       
CONECT   23   39   19   62   63                                       
CONECT   24   39   20   64   65                                       
CONECT   25   30   38   66   67                                       
CONECT   26   30   38   68   69                                       
CONECT   27   40   21   70   71                                       
CONECT   28   22   40   72   73                                       
CONECT   29   20   19   42   74                                       
CONECT   30   22   25   21   26                                       
CONECT   31    9   75   76   77                                       
CONECT   32   33   78   79   80                                       
CONECT   33   32   39   81   82                                       
CONECT   34    4    4   37                                            
CONECT   35   10   15   15                                            
CONECT   36   15   14   14                                            
CONECT   37   11   34   83                                            
CONECT   38   25   18   26                                            
CONECT   39   33   24   23                                            
CONECT   40   28   14   27                                            
CONECT   41   18   18                                                 
CONECT   42   29   15                                                 
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45    1                                                      
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   28                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
CONECT   75   31                                                      
CONECT   76   31                                                      
CONECT   77   31                                                      
CONECT   78   32                                                      
CONECT   79   32                                                      
CONECT   80   32                                                      
CONECT   81   33                                                      
CONECT   82   33                                                      
CONECT   83   37                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
