COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.274  43.586  67.046  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.497  43.496  65.864  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.074  44.603  64.934  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.534  44.566  64.941  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.857  45.695  64.165  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.173  45.693  62.706  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.977  43.206  64.502  1.00  0.00           C  
HETATM    8  N   UNL     1      -7.476  45.856  65.514  1.00  0.00           N  
HETATM    9  C   UNL     1      -8.695  46.390  65.337  1.00  0.00           C  
HETATM   10  O   UNL     1      -9.633  45.762  64.869  1.00  0.00           O  
HETATM   11  C   UNL     1      -8.894  47.828  65.765  1.00  0.00           C  
HETATM   12  C   UNL     1      -9.310  47.767  67.247  1.00  0.00           C  
HETATM   13  N   UNL     1      -9.967  48.461  64.966  1.00  0.00           N  
HETATM   14  N   UNL     1      -8.119  42.426  65.431  1.00  0.00           N  
HETATM   15  C   UNL     1      -8.487  42.039  64.069  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.262  40.728  64.267  1.00  0.00           C  
HETATM   17  C   UNL     1      -9.593  40.646  65.750  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.542  41.469  66.469  1.00  0.00           C  
HETATM   19  B   UNL     1      -7.229  40.626  66.951  1.00  0.00           B  
HETATM   20  O   UNL     1      -6.275  41.110  68.057  1.00  0.00           O  
HETATM   21  O   UNL     1      -6.511  39.774  65.922  1.00  0.00           O  
HETATM   22  H   UNL     1      -7.505  44.493  63.928  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.278  44.730  65.998  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.769  45.583  64.279  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.234  46.643  64.577  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.264  45.693  62.567  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.744  46.591  62.237  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.744  44.794  62.239  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.844  43.199  63.410  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.007  43.032  64.991  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.681  42.411  64.790  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.816  46.354  66.076  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.980  48.423  65.618  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.411  47.752  67.880  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.918  48.650  67.494  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.898  46.855  67.425  1.00  0.00           H  
HETATM   37  H   UNL     1     -10.772  48.604  65.542  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.647  49.342  64.617  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.599  41.891  63.437  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.078  42.809  63.552  1.00  0.00           H  
HETATM   41  H   UNL     1     -10.183  40.730  63.666  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.667  39.861  63.944  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.598  41.050  65.944  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.590  39.603  66.101  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.958  41.897  67.393  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.400  41.210  67.700  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.361  40.286  65.136  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   14                                       
CONECT    3    2    4    8   22                                       
CONECT    4    3    5    7   23                                       
CONECT    5    4    6   24   25                                       
CONECT    6    5   26   27   28                                       
CONECT    7    4   29   30   31                                       
CONECT    8    3    9   32                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   13   12   33                                       
CONECT   12   11   34   35   36                                       
CONECT   13   11   37   38                                            
CONECT   14    2   15   18                                            
CONECT   15   14   16   39   40                                       
CONECT   16   15   17   41   42                                       
CONECT   17   16   18   43   44                                       
CONECT   18   14   17   19   45                                       
CONECT   19   18   21   20                                            
CONECT   20   19   46                                                 
CONECT   21   19   47                                                 
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
