COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.551  -0.885   0.100  1.00  0.00           C  
HETATM    2  C   UNL     1       5.863  -1.098   1.259  1.00  0.00           C  
HETATM    3  C   UNL     1       4.501  -0.759   1.334  1.00  0.00           C  
HETATM    4  C   UNL     1       3.865  -0.198   0.200  1.00  0.00           C  
HETATM    5  C   UNL     1       4.597   0.010  -0.979  1.00  0.00           C  
HETATM    6  C   UNL     1       5.919  -0.329  -1.022  1.00  0.00           C  
HETATM    7  N   UNL     1       3.805  -0.959   2.459  1.00  0.00           N  
HETATM    8  C   UNL     1       2.532  -0.648   2.546  1.00  0.00           C  
HETATM    9  C   UNL     1       1.839  -0.094   1.477  1.00  0.00           C  
HETATM   10  C   UNL     1       2.496   0.141   0.282  1.00  0.00           C  
HETATM   11  O   UNL     1       1.845   0.680  -0.779  1.00  0.00           O  
HETATM   12  C   UNL     1       0.507   0.890  -0.667  1.00  0.00           C  
HETATM   13  C   UNL     1       0.032   1.953   0.088  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.220   1.316  -0.439  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.744   0.256  -1.198  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.384   0.044  -1.311  1.00  0.00           C  
HETATM   17  O   UNL     1      -8.391  -1.442   0.086  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.328   2.167   0.202  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.600   1.531  -0.324  1.00  0.00           N  
HETATM   20  O   UNL     1       6.629  -0.127  -2.164  1.00  0.00           O  
HETATM   21  O   UNL     1       7.869  -1.209   0.034  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.446   0.482  -0.295  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.019  -0.650  -0.447  1.00  0.00           O  
HETATM   24  N   UNL     1      -5.750   0.682  -0.100  1.00  0.00           N  
HETATM   25  C   UNL     1      -6.590  -0.359  -0.072  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.672  -3.856  -0.213  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.451  -2.369  -0.120  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.262  -1.726  -0.230  1.00  0.00           C  
HETATM   29  N   UNL     1      -7.929  -0.324   0.115  1.00  0.00           N  
HETATM   30 CL   UNL     1      -1.922   3.496   1.147  1.00  0.00          Cl  
HETATM   31  C   UNL     1       5.928   0.442  -3.272  1.00  0.00           C  
HETATM   32  C   UNL     1       8.460  -1.765   1.210  1.00  0.00           C  
HETATM   33  H   UNL     1       6.362  -1.526   2.115  1.00  0.00           H  
HETATM   34  H   UNL     1       4.118   0.437  -1.847  1.00  0.00           H  
HETATM   35  H   UNL     1       2.010  -0.827   3.474  1.00  0.00           H  
HETATM   36  H   UNL     1       0.793   0.151   1.578  1.00  0.00           H  
HETATM   37  H   UNL     1       0.726   2.614   0.586  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.013  -0.781  -1.902  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.437  -0.403  -1.701  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.946   2.435  -0.266  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.447   0.484   0.253  1.00  0.00           H  
HETATM   42  H   UNL     1       5.538   1.421  -2.991  1.00  0.00           H  
HETATM   43  H   UNL     1       6.609   0.549  -4.116  1.00  0.00           H  
HETATM   44  H   UNL     1       5.101  -0.211  -3.552  1.00  0.00           H  
HETATM   45  H   UNL     1       9.512  -1.979   1.023  1.00  0.00           H  
HETATM   46  H   UNL     1       8.374  -1.054   2.031  1.00  0.00           H  
HETATM   47  H   UNL     1       7.944  -2.688   1.474  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.287  -2.160  -0.399  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.732  -4.075  -0.086  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.343  -4.212  -1.189  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.101  -4.358   0.568  1.00  0.00           H  
CONECT    1    2    2    6   21                                       
CONECT    2    1    1    3   33                                       
CONECT    3    2    4    7    7                                       
CONECT    4    3    5   10   10                                       
CONECT    5    4    6    6   34                                       
CONECT    6    1    5    5   20                                       
CONECT    7    3    3    8                                            
CONECT    8    7    9    9   35                                       
CONECT    9    8    8   10   36                                       
CONECT   10    4    4    9   11                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   16   16                                       
CONECT   13   12   18   18   37                                       
CONECT   14   15   15   19   18                                       
CONECT   15   14   14   16   39                                       
CONECT   16   12   12   15   38                                       
CONECT   17   27   29                                                 
CONECT   18   13   13   14   30                                       
CONECT   19   14   22   40                                            
CONECT   20    6   31                                                 
CONECT   21    1   32                                                 
CONECT   22   19   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   25                                            
CONECT   25   24   24   28   29                                       
CONECT   26   27   49   50   51                                       
CONECT   27   17   26   28   28                                       
CONECT   28   25   27   27   48                                       
CONECT   29   17   25   41                                            
CONECT   30   18                                                      
CONECT   31   20   42   43   44                                       
CONECT   32   21   45   46   47                                       
CONECT   33    2                                                      
CONECT   34    5                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   15                                                      
CONECT   40   19                                                      
CONECT   41   29                                                      
CONECT   42   31                                                      
CONECT   43   31                                                      
CONECT   44   31                                                      
CONECT   45   32                                                      
CONECT   46   32                                                      
CONECT   47   32                                                      
CONECT   48   28                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
