COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.032  -2.482   0.414  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.691  -0.282   0.562  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.434   0.892   0.216  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.081  -1.244   0.845  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.317  -2.451   1.201  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.840   0.742  -2.680  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.621   1.556  -1.403  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.946   1.797  -0.728  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.830   3.094  -0.434  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.681   1.161   0.814  1.00  0.00           C  
HETATM   11  C   UNL     1       0.882  -1.457   0.546  1.00  0.00           C  
HETATM   12  C   UNL     1       2.070  -1.487  -0.183  1.00  0.00           C  
HETATM   13  C   UNL     1       3.055  -0.388  -0.044  1.00  0.00           C  
HETATM   14  C   UNL     1       4.243  -0.421  -0.775  1.00  0.00           C  
HETATM   15  C   UNL     1       5.159   0.599  -0.646  1.00  0.00           C  
HETATM   16  C   UNL     1       4.899   1.667   0.216  1.00  0.00           C  
HETATM   17  C   UNL     1       5.881   2.761   0.354  1.00  0.00           C  
HETATM   18  C   UNL     1       3.709   1.699   0.947  1.00  0.00           C  
HETATM   19  C   UNL     1       2.792   0.681   0.813  1.00  0.00           C  
HETATM   20  C   UNL     1       2.328  -2.554  -1.042  1.00  0.00           C  
HETATM   21  C   UNL     1       1.408  -3.574  -1.167  1.00  0.00           C  
HETATM   22  C   UNL     1       0.232  -3.542  -0.437  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.998  -2.430   2.697  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.662   2.870  -1.021  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.543   4.230  -0.774  1.00  0.00           N  
HETATM   26  N   UNL     1      -5.336   2.261   0.463  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.214   0.294   1.751  1.00  0.00           N  
HETATM   28  N   UNL     1       5.629   3.792   1.185  1.00  0.00           N  
HETATM   29  O   UNL     1       6.916   2.734  -0.283  1.00  0.00           O  
HETATM   30 CL   UNL     1      -0.922  -4.829  -0.599  1.00  0.00          Cl  
HETATM   31  H   UNL     1      -1.907  -3.337   0.968  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.497   1.293  -3.354  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.882   0.568  -3.169  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.299  -0.214  -2.428  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.965   1.005  -0.730  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.162   2.512  -1.656  1.00  0.00           H  
HETATM   37  H   UNL     1       0.677  -0.632   1.213  1.00  0.00           H  
HETATM   38  H   UNL     1       4.445  -1.247  -1.441  1.00  0.00           H  
HETATM   39  H   UNL     1       6.079   0.573  -1.212  1.00  0.00           H  
HETATM   40  H   UNL     1       3.506   2.524   1.614  1.00  0.00           H  
HETATM   41  H   UNL     1       1.872   0.706   1.378  1.00  0.00           H  
HETATM   42  H   UNL     1       3.245  -2.580  -1.612  1.00  0.00           H  
HETATM   43  H   UNL     1       1.607  -4.401  -1.833  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.432  -3.324   2.961  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.407  -1.544   2.930  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.927  -2.408   3.266  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.401   4.406  -0.356  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.186   4.849  -1.429  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.728  -0.507   2.001  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.073   0.488   2.157  1.00  0.00           H  
HETATM   51  H   UNL     1       4.803   3.814   1.693  1.00  0.00           H  
HETATM   52  H   UNL     1       6.274   4.511   1.276  1.00  0.00           H  
CONECT    1   22   22   11    5                                       
CONECT    2    3    4    4    4                                       
CONECT    3    8    2   10   10                                       
CONECT    4    2    2    2    5                                       
CONECT    5    1    4   23   31                                       
CONECT    6    7   32   33   34                                       
CONECT    7    6    8   35   36                                       
CONECT    8    7   24   24    3                                       
CONECT    9   24   25   26   26                                       
CONECT   10    3    3   26   27                                       
CONECT   11   12   12    1   37                                       
CONECT   12   20   13   11   11                                       
CONECT   13   14   14   19   12                                       
CONECT   14   15   13   13   38                                       
CONECT   15   16   16   14   39                                       
CONECT   16   17   15   15   18                                       
CONECT   17   29   29   16   28                                       
CONECT   18   16   19   19   40                                       
CONECT   19   18   18   13   41                                       
CONECT   20   21   21   12   42                                       
CONECT   21   20   20   22   43                                       
CONECT   22   21   30    1    1                                       
CONECT   23    5   44   45   46                                       
CONECT   24    8    8    9                                            
CONECT   25    9   47   48                                            
CONECT   26    9    9   10                                            
CONECT   27   10   49   50                                            
CONECT   28   17   51   52                                            
CONECT   29   17   17                                                 
CONECT   30   22                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
