COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.114   1.156   0.307  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.698  -0.733   1.567  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.252  -0.978   0.714  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.780   0.951  -0.842  1.00  0.00           C  
HETATM    5  C   UNL     1       0.393   1.202  -1.602  1.00  0.00           C  
HETATM    6  N   UNL     1      -4.871   1.228  -0.119  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.462   0.952  -2.859  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.811   0.435  -2.304  1.00  0.00           C  
HETATM    9  C   UNL     1       1.672   0.364  -1.664  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.360  -0.698   1.140  1.00  0.00           C  
HETATM   11  C   UNL     1       3.582  -0.357  -0.363  1.00  0.00           C  
HETATM   12  C   UNL     1       3.047  -1.720   0.080  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.969   0.332   0.268  1.00  0.00           C  
HETATM   14  CA  UNL     1       4.200  -2.725   0.144  1.00  0.00           C  
HETATM   15  C   UNL     1       2.962   1.983  -0.408  1.00  0.00           C  
HETATM   16  C   UNL     1       3.431   2.310   1.011  1.00  0.00           C  
HETATM   17  C   UNL     1       3.814   3.789   1.093  1.00  0.00           C  
HETATM   18  C   UNL     1       4.283   4.117   2.512  1.00  0.00           C  
HETATM   19  C   UNL     1       4.667   5.596   2.593  1.00  0.00           C  
HETATM   20  C   UNL     1       3.697  -4.033   0.697  1.00  0.00           C  
HETATM   21  N   UNL     1       2.471   0.599  -0.454  1.00  0.00           N  
HETATM   22  N   UNL     1      -6.142  -1.724   2.425  1.00  0.00           N  
HETATM   23  N   UNL     1       4.738  -2.938  -1.207  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.528   0.207   1.126  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.266  -1.462   1.372  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.635   0.129   0.017  1.00  0.00           N  
HETATM   27  O   UNL     1      -0.393   0.809  -0.465  1.00  0.00           O  
HETATM   28  O   UNL     1      -0.653   2.168  -3.584  1.00  0.00           O  
HETATM   29  O   UNL     1      -1.864  -0.993  -2.339  1.00  0.00           O  
HETATM   30  OXT UNL     1       3.536  -4.185   2.021  1.00  0.00           O  
HETATM   31  O   UNL     1       3.437  -4.945  -0.052  1.00  0.00           O  
HETATM   32  H   UNL     1      -6.821   1.903  -0.023  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.255  -1.393   0.719  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.085   1.997  -0.798  1.00  0.00           H  
HETATM   35  H   UNL     1       0.647   2.259  -1.530  1.00  0.00           H  
HETATM   36  H   UNL     1       0.004   0.199  -3.495  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.649   0.868  -2.851  1.00  0.00           H  
HETATM   38  H   UNL     1       1.411  -0.693  -1.728  1.00  0.00           H  
HETATM   39  H   UNL     1       2.251   0.649  -2.543  1.00  0.00           H  
HETATM   40  H   UNL     1       4.311   0.001   0.364  1.00  0.00           H  
HETATM   41  H   UNL     1       4.060  -0.454  -1.338  1.00  0.00           H  
HETATM   42  H   UNL     1       2.591  -1.629   1.066  1.00  0.00           H  
HETATM   43  H   UNL     1       2.302  -2.068  -0.634  1.00  0.00           H  
HETATM   44  HA  UNL     1       4.986  -2.335   0.790  1.00  0.00           H  
HETATM   45  H   UNL     1       2.158   2.663  -0.691  1.00  0.00           H  
HETATM   46  H   UNL     1       3.795   2.096  -1.101  1.00  0.00           H  
HETATM   47  H   UNL     1       2.625   2.105   1.717  1.00  0.00           H  
HETATM   48  H   UNL     1       4.296   1.696   1.259  1.00  0.00           H  
HETATM   49  H   UNL     1       4.619   3.995   0.387  1.00  0.00           H  
HETATM   50  H   UNL     1       2.948   4.404   0.845  1.00  0.00           H  
HETATM   51  H   UNL     1       3.478   3.911   3.217  1.00  0.00           H  
HETATM   52  H   UNL     1       5.149   3.503   2.759  1.00  0.00           H  
HETATM   53  H   UNL     1       5.001   5.830   3.604  1.00  0.00           H  
HETATM   54  H   UNL     1       5.472   5.802   1.888  1.00  0.00           H  
HETATM   55  H   UNL     1       3.801   6.210   2.345  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.527  -2.405   2.740  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.068  -1.737   2.713  1.00  0.00           H  
HETATM   58  H1  UNL     1       5.541  -3.548  -1.183  1.00  0.00           H  
HETATM   59  H2  UNL     1       4.027  -3.300  -1.826  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.185   2.069  -4.386  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.796  -1.367  -3.228  1.00  0.00           H  
HETATM   62  HXT UNL     1       3.211  -5.042   2.328  1.00  0.00           H  
CONECT    1   24   24    6   32                                       
CONECT    2   24   22   10   10                                       
CONECT    3   26   25   25   33                                       
CONECT    4    8   26   27   34                                       
CONECT    5    7    9   27   35                                       
CONECT    6    1   13   13                                            
CONECT    7    8   28    5   36                                       
CONECT    8   29    7    4   37                                       
CONECT    9    5   21   38   39                                       
CONECT   10    2    2   13   25                                       
CONECT   11   21   12   40   41                                       
CONECT   12   14   11   42   43                                       
CONECT   13    6    6   10   26                                       
CONECT   14   20   23   12   44                                       
CONECT   15   21   16   45   46                                       
CONECT   16   15   17   47   48                                       
CONECT   17   16   18   49   50                                       
CONECT   18   17   19   51   52                                       
CONECT   19   18   53   54   55                                       
CONECT   20   31   31   14   30                                       
CONECT   21    9   11   15                                            
CONECT   22    2   56   57                                            
CONECT   23   14   58   59                                            
CONECT   24    1    1    2                                            
CONECT   25   10    3    3                                            
CONECT   26   13    4    3                                            
CONECT   27    4    5                                                 
CONECT   28    7   60                                                 
CONECT   29    8   61                                                 
CONECT   30   20   62                                                 
CONECT   31   20   20                                                 
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
