COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.933  -1.810   0.246  1.00  0.00           C  
HETATM    2  C   UNL     1       1.641  -2.447  -0.921  1.00  0.00           C  
HETATM    3  O   UNL     1       1.518  -1.647   1.296  1.00  0.00           O  
HETATM    4  C   UNL     1       3.901   1.673  -0.525  1.00  0.00           C  
HETATM    5  C   UNL     1       4.098   2.047  -1.845  1.00  0.00           C  
HETATM    6  C   UNL     1       4.091   3.384  -2.193  1.00  0.00           C  
HETATM    7  C   UNL     1       3.889   4.350  -1.224  1.00  0.00           C  
HETATM    8  C   UNL     1       3.693   3.981   0.094  1.00  0.00           C  
HETATM    9  C   UNL     1       3.693   2.645   0.445  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.290  -0.423   1.081  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.300  -0.284  -0.185  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.812   0.803   0.511  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.152   1.119   0.406  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.985   0.354  -0.391  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.477  -0.729  -1.087  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.137  -1.050  -0.985  1.00  0.00           C  
HETATM   17  N   UNL     1       3.016  -2.777  -0.537  1.00  0.00           N  
HETATM   18  N   UNL     1       3.421  -3.886  -0.016  1.00  0.00           N  
HETATM   19  N   UNL     1       4.690  -3.811   0.186  1.00  0.00           N  
HETATM   20  N   UNL     1       5.117  -2.658  -0.201  1.00  0.00           N  
HETATM   21  C   UNL     1       4.095  -1.983  -0.666  1.00  0.00           C  
HETATM   22  C   UNL     1       4.122  -0.586  -1.232  1.00  0.00           C  
HETATM   23  O   UNL     1       3.907   0.358  -0.181  1.00  0.00           O  
HETATM   24 CL   UNL     1       3.447   2.181   2.100  1.00  0.00          Cl  
HETATM   25  N   UNL     1      -0.350  -1.415   0.122  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.007  -0.817   1.206  1.00  0.00           N  
HETATM   27  O   UNL     1      -2.860   0.096   2.022  1.00  0.00           O  
HETATM   28  N   UNL     1      -2.941  -0.604  -0.085  1.00  0.00           N  
HETATM   29 CL   UNL     1      -8.669   0.754  -0.520  1.00  0.00          Cl  
HETATM   30  H   UNL     1       1.117  -3.357  -1.212  1.00  0.00           H  
HETATM   31  H   UNL     1       1.656  -1.752  -1.761  1.00  0.00           H  
HETATM   32  H   UNL     1       4.257   1.293  -2.602  1.00  0.00           H  
HETATM   33  H   UNL     1       4.245   3.675  -3.221  1.00  0.00           H  
HETATM   34  H   UNL     1       3.885   5.395  -1.498  1.00  0.00           H  
HETATM   35  H   UNL     1       3.531   4.737   0.848  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.163   1.400   1.135  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.551   1.964   0.948  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.129  -1.325  -1.709  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.740  -1.893  -1.532  1.00  0.00           H  
HETATM   40  H   UNL     1       5.090  -0.400  -1.695  1.00  0.00           H  
HETATM   41  H   UNL     1       3.335  -0.482  -1.980  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.818  -1.545  -0.717  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.539  -0.687   2.045  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.467  -0.955  -0.855  1.00  0.00           H  
CONECT    1    2   25    3    3                                       
CONECT    2   17    1   30   31                                       
CONECT    3    1    1                                                 
CONECT    4    9   23    5    5                                       
CONECT    5    4    4    6   32                                       
CONECT    6    7    7    5   33                                       
CONECT    7    8    6    6   34                                       
CONECT    8    9    9    7   35                                       
CONECT    9   24    8    8    4                                       
CONECT   10   28   27   27   26                                       
CONECT   11   12   12   16   28                                       
CONECT   12   13   11   11   36                                       
CONECT   13   14   14   12   37                                       
CONECT   14   29   13   13   15                                       
CONECT   15   14   16   16   38                                       
CONECT   16   15   15   11   39                                       
CONECT   17    2   18   21                                            
CONECT   18   17   19   19                                            
CONECT   19   18   18   20                                            
CONECT   20   21   21   19                                            
CONECT   21   17   22   20   20                                       
CONECT   22   23   21   40   41                                       
CONECT   23    4   22                                                 
CONECT   24    9                                                      
CONECT   25   26    1   42                                            
CONECT   26   10   25   43                                            
CONECT   27   10   10                                                 
CONECT   28   11   10   44                                            
CONECT   29   14                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   28                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
