COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.846   1.189  -0.724  1.00  0.00           C  
HETATM    2  C   UNL     1       8.055   0.639  -0.342  1.00  0.00           C  
HETATM    3  C   UNL     1       8.081  -0.538   0.385  1.00  0.00           C  
HETATM    4  C   UNL     1       6.898  -1.167   0.730  1.00  0.00           C  
HETATM    5  C   UNL     1       5.688  -0.621   0.349  1.00  0.00           C  
HETATM    6  C   UNL     1       5.659   0.560  -0.379  1.00  0.00           C  
HETATM    7  C   UNL     1       3.287   0.400  -0.359  1.00  0.00           C  
HETATM    8  C   UNL     1       2.056   1.157  -0.862  1.00  0.00           C  
HETATM    9  C   UNL     1       0.790   0.405  -0.445  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.441   1.162  -0.947  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.707   0.410  -0.530  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.938   1.167  -1.032  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.062   1.050   0.075  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.937   3.044   1.008  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.258  -1.020   0.283  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.131  -1.841   0.244  1.00  0.00           C  
HETATM   17  O   UNL     1       4.469   1.102  -0.749  1.00  0.00           O  
HETATM   18  N   UNL     1      -4.150   0.447  -0.632  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.947   2.398   0.344  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.766   3.585   1.564  1.00  0.00           N  
HETATM   21  N   UNL     1      -6.142   0.342   0.554  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.288  -3.183  -0.033  1.00  0.00           C  
HETATM   23  N   UNL     1      -6.485  -3.691  -0.261  1.00  0.00           N  
HETATM   24  C   UNL     1      -7.575  -2.948  -0.234  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.503  -1.597   0.037  1.00  0.00           C  
HETATM   26 CL   UNL     1       9.601  -1.227   0.863  1.00  0.00          Cl  
HETATM   27  H   UNL     1       6.826   2.110  -1.287  1.00  0.00           H  
HETATM   28  H   UNL     1       8.979   1.128  -0.610  1.00  0.00           H  
HETATM   29  H   UNL     1       6.921  -2.086   1.297  1.00  0.00           H  
HETATM   30  H   UNL     1       4.765  -1.112   0.618  1.00  0.00           H  
HETATM   31  H   UNL     1       3.250   0.327   0.727  1.00  0.00           H  
HETATM   32  H   UNL     1       3.300  -0.600  -0.791  1.00  0.00           H  
HETATM   33  H   UNL     1       2.043   2.158  -0.430  1.00  0.00           H  
HETATM   34  H   UNL     1       2.093   1.230  -1.949  1.00  0.00           H  
HETATM   35  H   UNL     1       0.803  -0.595  -0.876  1.00  0.00           H  
HETATM   36  H   UNL     1       0.753   0.332   0.642  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.454   2.163  -0.515  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.404   1.235  -2.034  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.694  -0.590  -0.961  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.744   0.337   0.557  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.951   2.168  -0.600  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.901   1.240  -2.119  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.149  -1.431   0.429  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.158   2.884   0.058  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.821   0.791   1.081  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.421  -3.826  -0.065  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.535  -3.403  -0.425  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.399  -0.995   0.058  1.00  0.00           H  
CONECT    1    2    2    6   27                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2   26    4    4                                       
CONECT    4    3    3    5   29                                       
CONECT    5    6    6    4   30                                       
CONECT    6    1   17    5    5                                       
CONECT    7   17    8   31   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8   10   35   36                                       
CONECT   10    9   11   37   38                                       
CONECT   11   10   12   39   40                                       
CONECT   12   11   18   41   42                                       
CONECT   13   18   18   19   21                                       
CONECT   14   20   20   20   19                                       
CONECT   15   21   16   16   25                                       
CONECT   16   15   15   22   43                                       
CONECT   17    6    7                                                 
CONECT   18   12   13   13                                            
CONECT   19   14   13   44                                            
CONECT   20   14   14   14                                            
CONECT   21   13   15   45                                            
CONECT   22   16   23   23   46                                       
CONECT   23   22   22   24                                            
CONECT   24   25   25   23   47                                       
CONECT   25   15   24   24   48                                       
CONECT   26    3                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   16                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
