COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.469  -0.423   0.470  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.318  -1.691   0.587  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.118  -2.555  -0.660  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.642  -2.938  -0.784  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.794  -1.670  -0.901  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.994  -0.806   0.345  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.145   0.462   0.228  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.760   0.110   0.229  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.868   1.125   0.131  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.281   2.385   0.039  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.415   3.385  -0.057  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.897   4.681  -0.150  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.108   3.189  -0.066  1.00  0.00           N  
HETATM   14  C   UNL     1       0.393   1.952   0.023  1.00  0.00           C  
HETATM   15  N   UNL     1       1.638   1.446   0.040  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.498   0.869   0.131  1.00  0.00           C  
HETATM   17  N   UNL     1       0.283  -0.268   0.212  1.00  0.00           N  
HETATM   18  C   UNL     1       1.586   0.137   0.145  1.00  0.00           C  
HETATM   19  C   UNL     1       2.760  -0.761   0.193  1.00  0.00           C  
HETATM   20  C   UNL     1       2.590  -2.122   0.457  1.00  0.00           C  
HETATM   21  C   UNL     1       3.685  -2.961   0.503  1.00  0.00           C  
HETATM   22  C   UNL     1       4.955  -2.463   0.288  1.00  0.00           C  
HETATM   23  C   UNL     1       5.139  -1.104   0.023  1.00  0.00           C  
HETATM   24  C   UNL     1       6.498  -0.572  -0.206  1.00  0.00           C  
HETATM   25  O   UNL     1       6.670   0.625  -0.324  1.00  0.00           O  
HETATM   26  O   UNL     1       7.547  -1.414  -0.284  1.00  0.00           O  
HETATM   27  C   UNL     1       4.037  -0.252  -0.030  1.00  0.00           C  
HETATM   28  C   UNL     1       4.227   1.214  -0.321  1.00  0.00           C  
HETATM   29  H   UNL     1      -6.775   0.138  -0.414  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.611   0.193   1.358  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.012  -2.251   1.470  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.369  -1.417   0.676  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.688  -1.367   1.229  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.723  -3.458  -0.576  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.424  -1.994  -1.543  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.337  -3.499   0.099  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.501  -3.553  -1.672  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.743  -1.943  -0.990  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.100  -1.109  -1.785  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.389   0.977  -0.701  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.354   1.118   1.073  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.853   4.844  -0.145  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.279   5.425  -0.221  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.034  -1.181   0.293  1.00  0.00           H  
HETATM   45  H   UNL     1       1.600  -2.518   0.627  1.00  0.00           H  
HETATM   46  H   UNL     1       3.548  -4.013   0.708  1.00  0.00           H  
HETATM   47  H   UNL     1       5.807  -3.125   0.325  1.00  0.00           H  
HETATM   48  H   UNL     1       8.417  -1.019  -0.435  1.00  0.00           H  
HETATM   49  H   UNL     1       4.448   1.744   0.606  1.00  0.00           H  
HETATM   50  H   UNL     1       5.055   1.342  -1.018  1.00  0.00           H  
HETATM   51  H   UNL     1       3.316   1.618  -0.762  1.00  0.00           H  
CONECT    1    2    6   29   30                                       
CONECT    2    1    3   31   32                                       
CONECT    3    2    4   34   35                                       
CONECT    4    3    5   36   37                                       
CONECT    5    4    6   38   39                                       
CONECT    6    1    5    7   33                                       
CONECT    7    6    8   40   41                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   16   16                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   13                                       
CONECT   12   11   42   43                                            
CONECT   13   11   14   14                                            
CONECT   14   13   13   15   16                                       
CONECT   15   14   18   18                                            
CONECT   16    9    9   14   17                                       
CONECT   17   16   18   44                                            
CONECT   18   15   15   17   19                                       
CONECT   19   18   20   27   27                                       
CONECT   20   19   21   21   45                                       
CONECT   21   20   20   22   46                                       
CONECT   22   21   23   23   47                                       
CONECT   23   22   22   24   27                                       
CONECT   24   23   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   48                                                 
CONECT   27   19   19   23   28                                       
CONECT   28   27   49   50   51                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    6                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
