COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.188   1.397  -0.047  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.583   0.910  -0.076  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.166  -0.904  -0.020  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.795   2.702  -0.116  1.00  0.00           N  
HETATM    5  C   UNL     1       0.572   2.712  -0.056  1.00  0.00           C  
HETATM    6  O   UNL     1       2.725   0.185  -1.018  1.00  0.00           O  
HETATM    7  C   UNL     1       4.071  -0.293  -1.043  1.00  0.00           C  
HETATM    8  C   UNL     1       4.308  -1.210   0.161  1.00  0.00           C  
HETATM    9  C   UNL     1       4.007  -0.437   1.448  1.00  0.00           C  
HETATM   10  C   UNL     1       2.570   0.089   1.392  1.00  0.00           C  
HETATM   11  C   UNL     1       2.401   0.956   0.141  1.00  0.00           C  
HETATM   12  C   UNL     1       0.973   1.428   0.047  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.113   0.647   0.055  1.00  0.00           N  
HETATM   14  O   UNL     1       2.302   0.873   2.556  1.00  0.00           O  
HETATM   15  O   UNL     1       4.154  -1.306   2.573  1.00  0.00           O  
HETATM   16  O   UNL     1       5.669  -1.645   0.170  1.00  0.00           O  
HETATM   17  C   UNL     1       4.311  -1.076  -2.335  1.00  0.00           C  
HETATM   18  O   UNL     1       4.204  -0.193  -3.454  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.641   1.829  -0.188  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.931   1.407  -0.216  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.224   0.034  -0.133  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.839  -0.449   0.003  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.550  -0.427  -0.155  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.803  -1.762  -0.068  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.764  -2.684   0.044  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.465  -2.275   0.069  1.00  0.00           C  
HETATM   27  H   UNL     1      -1.376   3.475  -0.193  1.00  0.00           H  
HETATM   28  H   UNL     1       1.209   3.583  -0.089  1.00  0.00           H  
HETATM   29  H   UNL     1       4.758   0.552  -0.996  1.00  0.00           H  
HETATM   30  H   UNL     1       3.649  -2.076   0.094  1.00  0.00           H  
HETATM   31  H   UNL     1       4.699   0.401   1.540  1.00  0.00           H  
HETATM   32  H   UNL     1       1.876  -0.751   1.350  1.00  0.00           H  
HETATM   33  H   UNL     1       3.066   1.817   0.203  1.00  0.00           H  
HETATM   34  H   UNL     1       2.395   0.388   3.387  1.00  0.00           H  
HETATM   35  H   UNL     1       3.979  -0.881   3.424  1.00  0.00           H  
HETATM   36  H   UNL     1       5.890  -2.230   0.907  1.00  0.00           H  
HETATM   37  H   UNL     1       5.309  -1.515  -2.314  1.00  0.00           H  
HETATM   38  H   UNL     1       3.567  -1.867  -2.424  1.00  0.00           H  
HETATM   39  H   UNL     1       4.345  -0.622  -4.309  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.424   2.885  -0.253  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.732   2.126  -0.303  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.023  -1.152   0.084  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.367   0.275  -0.241  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.824  -2.112  -0.086  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.991  -3.737   0.112  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.670  -3.000   0.155  1.00  0.00           H  
CONECT    1    4   13   13    2                                       
CONECT    2    1   22   22   19                                       
CONECT    3   22   26   26   21                                       
CONECT    4    5    1   27                                            
CONECT    5   12   12    4   28                                       
CONECT    6    7   11                                                 
CONECT    7    8   17    6   29                                       
CONECT    8   16    9    7   30                                       
CONECT    9   15    8   10   31                                       
CONECT   10    9   14   11   32                                       
CONECT   11   10    6   12   33                                       
CONECT   12   11    5    5   13                                       
CONECT   13   12    1    1                                            
CONECT   14   10   34                                                 
CONECT   15    9   35                                                 
CONECT   16    8   36                                                 
CONECT   17   18    7   37   38                                       
CONECT   18   17   39                                                 
CONECT   19    2   20   20   40                                       
CONECT   20   19   19   21   41                                       
CONECT   21    3   20   23   23                                       
CONECT   22    2    2    3   42                                       
CONECT   23   21   21   24   43                                       
CONECT   24   25   25   23   44                                       
CONECT   25   26   24   24   45                                       
CONECT   26    3    3   25   46                                       
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
