COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.443  -0.884   1.486  1.00  0.00           C  
HETATM    2  C   UNL     1       1.502  -1.516   0.620  1.00  0.00           C  
HETATM    3  N   UNL     1       2.707  -0.926   0.490  1.00  0.00           N  
HETATM    4  C   UNL     1       3.737  -1.541  -0.352  1.00  0.00           C  
HETATM    5  C   UNL     1       4.998  -0.676  -0.328  1.00  0.00           C  
HETATM    6  C   UNL     1       6.074  -1.318  -1.207  1.00  0.00           C  
HETATM    7  O   UNL     1       6.464  -2.572  -0.643  1.00  0.00           O  
HETATM    8  C   UNL     1       7.290  -0.393  -1.283  1.00  0.00           C  
HETATM    9  O   UNL     1       8.246  -0.936  -2.195  1.00  0.00           O  
HETATM   10  O   UNL     1       1.271  -2.556   0.041  1.00  0.00           O  
HETATM   11  N   UNL     1      -0.592  -1.883   1.827  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.256   0.252   0.715  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.138   1.548   1.473  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.637   1.645   2.759  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.529   2.835   3.455  1.00  0.00           C  
HETATM   16  C   UNL     1       0.475   2.641   0.885  1.00  0.00           C  
HETATM   17  F   UNL     1       0.966   2.546  -0.370  1.00  0.00           F  
HETATM   18  C   UNL     1       0.582   3.833   1.584  1.00  0.00           C  
HETATM   19 CL   UNL     1       1.350   5.205   0.847  1.00  0.00          Cl  
HETATM   20  C   UNL     1       0.078   3.929   2.867  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.737  -0.180   0.617  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.533   0.442   1.687  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.147   0.923   2.513  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.304   0.165  -0.736  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.687  -0.300  -1.885  1.00  0.00           C  
HETATM   26  F   UNL     1      -0.573  -1.060  -1.793  1.00  0.00           F  
HETATM   27  C   UNL     1      -2.211   0.013  -3.127  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.444   0.942  -0.831  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.964   1.258  -2.071  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.352   0.789  -3.220  1.00  0.00           C  
HETATM   31 CL   UNL     1      -4.010   1.183  -4.777  1.00  0.00          Cl  
HETATM   32  C   UNL     1      -1.663  -1.721   0.811  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.992  -2.268   1.335  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.889  -3.785   1.500  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.259  -4.351   1.882  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.429  -4.412   0.182  1.00  0.00           C  
HETATM   37  C   UNL     1      -1.878  -4.111   2.600  1.00  0.00           C  
HETATM   38  H   UNL     1       0.895  -0.491   2.397  1.00  0.00           H  
HETATM   39  H   UNL     1       2.892  -0.094   0.953  1.00  0.00           H  
HETATM   40  H   UNL     1       3.970  -2.535   0.028  1.00  0.00           H  
HETATM   41  H   UNL     1       3.370  -1.619  -1.375  1.00  0.00           H  
HETATM   42  H   UNL     1       4.765   0.319  -0.707  1.00  0.00           H  
HETATM   43  H   UNL     1       5.365  -0.597   0.696  1.00  0.00           H  
HETATM   44  H   UNL     1       5.676  -1.478  -2.209  1.00  0.00           H  
HETATM   45  H   UNL     1       6.828  -2.505   0.250  1.00  0.00           H  
HETATM   46  H   UNL     1       6.976   0.592  -1.629  1.00  0.00           H  
HETATM   47  H   UNL     1       7.741  -0.303  -0.294  1.00  0.00           H  
HETATM   48  H   UNL     1       9.045  -0.400  -2.293  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.950  -1.730   2.758  1.00  0.00           H  
HETATM   50  H   UNL     1       0.177   0.355  -0.280  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.111   0.791   3.220  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.920   2.909   4.459  1.00  0.00           H  
HETATM   53  H   UNL     1       0.161   4.858   3.413  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.730  -0.350  -4.024  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.927   1.301   0.066  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.855   1.865  -2.143  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.386  -2.213  -0.122  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.218  -1.812   2.299  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.786  -2.032   0.626  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.587  -3.904   2.821  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.979  -4.118   1.098  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.186  -5.432   2.000  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.356  -5.493   0.299  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.150  -4.179  -0.602  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.454  -4.009  -0.090  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.121  -3.542   3.497  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.916  -5.177   2.825  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.876  -3.847   2.263  1.00  0.00           H  
CONECT    1   11    2   12   38                                       
CONECT    2    3   10   10    1                                       
CONECT    3    4    2   39                                            
CONECT    4    5    3   40   41                                       
CONECT    5    6    4   42   43                                       
CONECT    6    7    5    8   44                                       
CONECT    7    6   45                                                 
CONECT    8    6    9   46   47                                       
CONECT    9    8   48                                                 
CONECT   10    2    2                                                 
CONECT   11   32    1   49                                            
CONECT   12   21    1   13   50                                       
CONECT   13   12   16   16   14                                       
CONECT   14   13   15   15   51                                       
CONECT   15   14   14   20   52                                       
CONECT   16   17   13   13   18                                       
CONECT   17   16                                                      
CONECT   18   16   19   20   20                                       
CONECT   19   18                                                      
CONECT   20   18   18   15   53                                       
CONECT   21   32   24   12   22                                       
CONECT   22   21   23   23   23                                       
CONECT   23   22   22   22                                            
CONECT   24   25   25   28   21                                       
CONECT   25   27   26   24   24                                       
CONECT   26   25                                                      
CONECT   27   30   30   25   54                                       
CONECT   28   29   29   24   55                                       
CONECT   29   30   28   28   56                                       
CONECT   30   31   27   27   29                                       
CONECT   31   30                                                      
CONECT   32   33   11   21   57                                       
CONECT   33   34   32   58   59                                       
CONECT   34   36   35   37   33                                       
CONECT   35   34   60   61   62                                       
CONECT   36   34   63   64   65                                       
CONECT   37   34   66   67   68                                       
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   20                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   37                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
