COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.413  -0.751   0.766  1.00  0.00           C  
HETATM    2  C   UNL     1       6.433  -2.018   0.211  1.00  0.00           C  
HETATM    3  C   UNL     1       5.379  -2.454  -0.570  1.00  0.00           C  
HETATM    4  O   UNL     1       2.024   2.278  -0.960  1.00  0.00           O  
HETATM    5  O   UNL     1       1.469  -1.977   0.272  1.00  0.00           O  
HETATM    6  C   UNL     1       1.683   0.201  -0.358  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.225  -2.023   0.326  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.538   0.374  -0.347  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.276  -0.610  -1.007  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.655  -0.562  -0.991  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.306   0.460  -0.323  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.581   1.439   0.333  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.202   1.402   0.325  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.812   0.507  -0.310  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.757  -0.024   1.031  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.012  -1.674   0.723  1.00  0.00           C  
HETATM   17  C   UNL     1       5.335   0.084   0.547  1.00  0.00           C  
HETATM   18  C   UNL     1       0.920  -0.929  -0.021  1.00  0.00           C  
HETATM   19  C   UNL     1       4.299  -1.627  -0.801  1.00  0.00           C  
HETATM   20  C   UNL     1       4.266  -0.353  -0.236  1.00  0.00           C  
HETATM   21  C   UNL     1       3.105   0.538  -0.475  1.00  0.00           C  
HETATM   22  C   UNL     1       1.041   1.406  -0.696  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.358   1.446  -0.687  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.061   0.325  -0.354  1.00  0.00           C  
HETATM   25  N   UNL     1       3.129   1.799  -0.839  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.428  -0.845  -0.026  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.316  -0.242   0.849  1.00  0.00           N  
HETATM   28 CL   UNL     1       5.310   1.674   1.244  1.00  0.00          Cl  
HETATM   29  H   UNL     1       7.239  -0.416   1.375  1.00  0.00           H  
HETATM   30  H   UNL     1       7.277  -2.669   0.389  1.00  0.00           H  
HETATM   31  H   UNL     1       5.401  -3.444  -1.001  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.499  -2.560  -0.582  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.642  -2.677   0.974  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.129  -1.707   0.848  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.769  -1.408  -1.529  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.227  -1.322  -1.502  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.096   2.234   0.852  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.638   2.164   0.841  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.143   1.543  -0.244  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.198   0.060  -1.227  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.290  -0.358   0.141  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.104  -0.590   1.896  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.946   1.037   1.192  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.932  -1.812   0.660  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.395  -2.205   1.594  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.482  -2.067  -0.178  1.00  0.00           H  
HETATM   47  H   UNL     1       3.476  -1.969  -1.411  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.878   2.358  -0.941  1.00  0.00           H  
CONECT    1   17   17    2   29                                       
CONECT    2    1    3    3   30                                       
CONECT    3    2    2   19   31                                       
CONECT    4   22   25                                                 
CONECT    5   18   18                                                 
CONECT    6   18   22   22   21                                       
CONECT    7   26   32   33   34                                       
CONECT    8    9    9   13   24                                       
CONECT    9   10    8    8   35                                       
CONECT   10   11   11    9   36                                       
CONECT   11   14   10   10   12                                       
CONECT   12   11   13   13   37                                       
CONECT   13   12   12    8   38                                       
CONECT   14   27   11   39   40                                       
CONECT   15   27   41   42   43                                       
CONECT   16   27   44   45   46                                       
CONECT   17   28    1    1   20                                       
CONECT   18   26    5    5    6                                       
CONECT   19   20   20    3   47                                       
CONECT   20   17   21   19   19                                       
CONECT   21    6   20   25   25                                       
CONECT   22   23    6    6    4                                       
CONECT   23   24   24   22   48                                       
CONECT   24    8   26   23   23                                       
CONECT   25    4   21   21                                            
CONECT   26    7   24   18                                            
CONECT   27   14   15   16                                            
CONECT   28   17                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   23                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
