COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.456   0.324   0.109  1.00  0.00           C  
HETATM    2  O   UNL     1       6.554   0.800   1.220  1.00  0.00           O  
HETATM    3  C   UNL     1       7.682   0.162  -0.752  1.00  0.00           C  
HETATM    4  N   UNL     1       5.251  -0.061  -0.356  1.00  0.00           N  
HETATM    5  C   UNL     1       4.059   0.096   0.482  1.00  0.00           C  
HETATM    6  C   UNL     1       2.851  -0.407  -0.266  1.00  0.00           C  
HETATM    7  O   UNL     1       2.973  -0.853  -1.387  1.00  0.00           O  
HETATM    8  N   UNL     1       1.634  -0.362   0.312  1.00  0.00           N  
HETATM    9  CA  UNL     1       0.459  -0.851  -0.414  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.777  -0.171   0.116  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.686   0.641   1.011  1.00  0.00           O  
HETATM   12  C   UNL     1       0.333  -2.363  -0.220  1.00  0.00           C  
HETATM   13  O   UNL     1       0.072  -2.647   1.156  1.00  0.00           O  
HETATM   14  C   UNL     1      -4.388  -0.680  -0.148  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.984  -0.467  -0.406  1.00  0.00           N  
HETATM   16  O   UNL     1      -4.312  -1.596  -0.931  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.186   0.193   0.108  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.373   1.537  -0.599  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.213   2.468  -0.238  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.685  -0.405   0.569  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.332   3.765  -1.041  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.262   2.788   1.257  1.00  0.00           C  
HETATM   23  O   UNL     1      -6.666  -1.362   0.161  1.00  0.00           O  
HETATM   24  H   UNL     1       7.400  -0.279  -1.708  1.00  0.00           H  
HETATM   25  H   UNL     1       8.137   1.138  -0.923  1.00  0.00           H  
HETATM   26  H   UNL     1       8.397  -0.488  -0.248  1.00  0.00           H  
HETATM   27  H   UNL     1       5.173  -0.442  -1.244  1.00  0.00           H  
HETATM   28  H   UNL     1       3.923   1.149   0.726  1.00  0.00           H  
HETATM   29  H   UNL     1       4.182  -0.477   1.401  1.00  0.00           H  
HETATM   30  H   UNL     1       1.536  -0.005   1.209  1.00  0.00           H  
HETATM   31  HA  UNL     1       0.570  -0.628  -1.475  1.00  0.00           H  
HETATM   32  H1  UNL     1      -0.487  -2.740  -0.831  1.00  0.00           H  
HETATM   33  H2  UNL     1       1.262  -2.847  -0.521  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.020  -3.589   1.352  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.057  -1.117  -1.123  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.079   0.359   1.180  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.391   1.381  -1.678  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.313   1.988  -0.281  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.268   1.980  -0.475  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.031   0.598   0.322  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.529  -0.481   1.645  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.278   4.254  -0.805  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.506   4.429  -0.784  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.297   3.538  -2.106  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.208   3.276   1.494  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.178   1.864   1.829  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.436   3.451   1.514  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.528  -1.245   0.584  1.00  0.00           H  
CONECT    1    4    3    2    2                                       
CONECT    2    1    1                                                 
CONECT    3    1   24   25   26                                       
CONECT    4    5    1   27                                            
CONECT    5    6    4   28   29                                       
CONECT    6    8    5    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    9    6   30                                            
CONECT    9   10   12    8   31                                       
CONECT   10   15   11   11    9                                       
CONECT   11   10   10                                                 
CONECT   12    9   32   33   13                                       
CONECT   13   12   34                                                 
CONECT   14   20   17   16   16                                       
CONECT   15   10   35   17                                            
CONECT   16   14   14                                                 
CONECT   17   14   15   36   18                                       
CONECT   18   17   37   38   19                                       
CONECT   19   18   22   21   39                                       
CONECT   20   14   40   23   41                                       
CONECT   21   19   42   43   44                                       
CONECT   22   19   45   46   47                                       
CONECT   23   20   48                                                 
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
