COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.953  -1.111  -1.248  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.066   2.861  -1.839  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.925   1.644  -1.186  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.977  -0.477  -1.037  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.002  -1.404  -0.907  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.799  -2.564  -0.182  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.544  -1.882   0.281  1.00  0.00           C  
HETATM    8  C   UNL     1       4.210  -1.020   0.325  1.00  0.00           C  
HETATM    9  C   UNL     1       6.219   0.169  -1.141  1.00  0.00           C  
HETATM   10  C   UNL     1       5.715   2.341  -0.109  1.00  0.00           C  
HETATM   11  C   UNL     1       3.675   1.136   1.380  1.00  0.00           C  
HETATM   12  C   UNL     1       4.436   0.358   0.496  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.748  -0.715  -0.443  1.00  0.00           C  
HETATM   14  O   UNL     1       1.763  -0.954  -0.667  1.00  0.00           O  
HETATM   15  C   UNL     1       1.813  -1.572   0.375  1.00  0.00           C  
HETATM   16  C   UNL     1       3.126  -1.723   1.100  1.00  0.00           C  
HETATM   17  C   UNL     1       3.941   2.467   1.501  1.00  0.00           C  
HETATM   18  C   UNL     1       4.957   3.066   0.759  1.00  0.00           C  
HETATM   19  C   UNL     1       5.471   0.968  -0.261  1.00  0.00           C  
HETATM   20  C   UNL     1       4.992  -1.706  -0.554  1.00  0.00           C  
HETATM   21  N   UNL     1       0.694  -2.124   0.886  1.00  0.00           N  
HETATM   22  C   UNL     1      -1.575  -2.803   0.417  1.00  0.00           C  
HETATM   23 CL   UNL     1      -4.082  -3.722  -0.022  1.00  0.00          Cl  
HETATM   24  O   UNL     1      -2.178   0.662  -1.750  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.826   3.859  -1.253  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.423   3.605  -0.029  1.00  0.00           C  
HETATM   27  N   UNL     1      -3.512   1.431  -0.020  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.241   2.366   0.570  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.821   2.108   1.769  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.597   0.814   2.333  1.00  0.00           C  
HETATM   31  H   UNL     1      -2.584   3.029  -2.791  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.958  -1.220  -1.373  1.00  0.00           H  
HETATM   33  H   UNL     1       7.012   0.608  -1.727  1.00  0.00           H  
HETATM   34  H   UNL     1       6.499   2.820  -0.678  1.00  0.00           H  
HETATM   35  H   UNL     1       2.885   0.684   1.961  1.00  0.00           H  
HETATM   36  H   UNL     1       0.052   0.002  -0.549  1.00  0.00           H  
HETATM   37  H   UNL     1       3.371  -2.782   1.190  1.00  0.00           H  
HETATM   38  H   UNL     1       3.045  -1.283   2.094  1.00  0.00           H  
HETATM   39  H   UNL     1       3.356   3.067   2.182  1.00  0.00           H  
HETATM   40  H   UNL     1       5.147   4.123   0.875  1.00  0.00           H  
HETATM   41  H   UNL     1       4.824  -2.764  -0.690  1.00  0.00           H  
HETATM   42  H   UNL     1       0.747  -2.688   1.674  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.418  -3.711   0.980  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.951   4.815  -1.740  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.022   4.362   0.455  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.115   0.740   3.289  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.976   0.051   1.654  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.528   0.665   2.486  1.00  0.00           H  
CONECT    1    9    9   20                                            
CONECT    2   25   25    3   31                                       
CONECT    3    2   24   27   27                                       
CONECT    4   13   13    5   24                                       
CONECT    5    6    6    4   32                                       
CONECT    6   22   23    5    5                                       
CONECT    7   21   22   22   13                                       
CONECT    8   20   20   12   16                                       
CONECT    9    1    1   19   33                                       
CONECT   10   19   19   18   34                                       
CONECT   11   12   12   17   35                                       
CONECT   12   19    8   11   11                                       
CONECT   13    7    4    4   36                                       
CONECT   14   15   15                                                 
CONECT   15   16   14   14   21                                       
CONECT   16    8   15   37   38                                       
CONECT   17   18   18   11   39                                       
CONECT   18   10   17   17   40                                       
CONECT   19    9   10   10   12                                       
CONECT   20    1    8    8   41                                       
CONECT   21   15    7   42                                            
CONECT   22    7    7    6   43                                       
CONECT   23    6                                                      
CONECT   24    3    4                                                 
CONECT   25    2    2   26   44                                       
CONECT   26   25   28   28   45                                       
CONECT   27    3    3   28                                            
CONECT   28   26   26   27   29                                       
CONECT   29   28   30                                                 
CONECT   30   29   46   47   48                                       
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
