COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.469   0.807   1.512  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.701  -0.252   1.217  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.602   0.800  -1.982  1.00  0.00           O  
HETATM    4  N   UNL     1      -5.965   1.828  -0.536  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.026  -0.287  -0.011  1.00  0.00           C  
HETATM    6  O   UNL     1       2.159   1.217  -1.077  1.00  0.00           O  
HETATM    7  N   UNL     1      -5.391  -1.403   1.881  1.00  0.00           N  
HETATM    8  C   UNL     1      -5.173   0.796  -0.906  1.00  0.00           C  
HETATM    9  O   UNL     1       5.985  -3.211   0.461  1.00  0.00           O  
HETATM   10  N   UNL     1      -7.396   2.869   1.021  1.00  0.00           N  
HETATM   11  C   UNL     1      -6.598   1.808   0.672  1.00  0.00           C  
HETATM   12  O   UNL     1       3.828  -2.791   0.148  1.00  0.00           O  
HETATM   13  C   UNL     1      -4.285  -1.547  -0.038  1.00  0.00           C  
HETATM   14  N   UNL     1       2.805  -0.499   0.177  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.544  -2.171   1.123  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.439   0.270  -1.455  1.00  0.00           C  
HETATM   17  C   UNL     1       0.522  -0.408  -0.704  1.00  0.00           C  
HETATM   18  C   UNL     1       0.197  -1.624  -0.099  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.070  -2.147  -0.248  1.00  0.00           C  
HETATM   20  C   UNL     1       1.879   0.158  -0.549  1.00  0.00           C  
HETATM   21  C   UNL     1       4.107  -0.014   0.246  1.00  0.00           C  
HETATM   22  C   UNL     1       4.343   1.354   0.257  1.00  0.00           C  
HETATM   23  C   UNL     1       5.636   1.834   0.326  1.00  0.00           C  
HETATM   24  C   UNL     1       6.708   0.955   0.384  1.00  0.00           C  
HETATM   25  C   UNL     1       6.494  -0.406   0.374  1.00  0.00           C  
HETATM   26  C   UNL     1       5.190  -0.905   0.312  1.00  0.00           C  
HETATM   27  C   UNL     1       4.953  -2.359   0.301  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.402  -2.047  -1.151  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.019  -1.470  -0.994  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.703  -0.265  -1.596  1.00  0.00           C  
HETATM   31 CL   UNL     1       5.923   3.546   0.338  1.00  0.00          Cl  
HETATM   32  H   UNL     1      -6.083   2.584  -1.132  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.721  -1.643   2.761  1.00  0.00           H  
HETATM   34  H   UNL     1       5.781  -4.156   0.447  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.853   2.871   1.876  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.502   3.616   0.412  1.00  0.00           H  
HETATM   37  H   UNL     1       2.564  -1.310   0.651  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.145  -3.132   1.415  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.195   1.213  -1.922  1.00  0.00           H  
HETATM   40  H   UNL     1       0.937  -2.154   0.483  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.323  -3.088   0.219  1.00  0.00           H  
HETATM   42  H   UNL     1       3.513   2.045   0.211  1.00  0.00           H  
HETATM   43  H   UNL     1       7.716   1.339   0.438  1.00  0.00           H  
HETATM   44  H   UNL     1       7.332  -1.086   0.419  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.348  -3.135  -1.111  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.817  -1.739  -2.111  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.449   0.261  -2.173  1.00  0.00           H  
CONECT    1   11   11    2                                            
CONECT    2    1    7    5    5                                       
CONECT    3    8    8                                                 
CONECT    4   11    8   32                                            
CONECT    5    2    2    8   13                                       
CONECT    6   20   20                                                 
CONECT    7    2   15   33                                            
CONECT    8    4    5    3    3                                       
CONECT    9   27   34                                                 
CONECT   10   11   35   36                                            
CONECT   11   10    1    1    4                                       
CONECT   12   27   27                                                 
CONECT   13    5   15   15   28                                       
CONECT   14   21   20   37                                            
CONECT   15    7   13   13   38                                       
CONECT   16   17   17   30   39                                       
CONECT   17   18   20   16   16                                       
CONECT   18   19   19   17   40                                       
CONECT   19   18   18   29   41                                       
CONECT   20   14   17    6    6                                       
CONECT   21   26   26   22   14                                       
CONECT   22   23   23   21   42                                       
CONECT   23   24   31   22   22                                       
CONECT   24   25   25   23   43                                       
CONECT   25   24   24   26   44                                       
CONECT   26   25   27   21   21                                       
CONECT   27   12   12    9   26                                       
CONECT   28   13   29   45   46                                       
CONECT   29   19   28   30   30                                       
CONECT   30   29   29   16   47                                       
CONECT   31   23                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   28                                                      
CONECT   46   28                                                      
CONECT   47   30                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
