COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.644  -3.496  -0.667  1.00  0.00           C  
HETATM    2  C   UNL     1       1.876  -2.878  -0.661  1.00  0.00           C  
HETATM    3  C   UNL     1       0.832  -0.814   0.050  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.502  -2.796  -0.325  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.425  -1.458   0.035  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.600   0.993  -1.613  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.454   1.986  -1.913  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.093   0.361  -0.389  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.648  -0.713   0.404  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.370  -1.068   1.538  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.516  -0.370   1.882  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.959   0.684   1.111  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.257   1.062  -0.030  1.00  0.00           C  
HETATM   14  C   UNL     1       1.987  -1.537  -0.304  1.00  0.00           C  
HETATM   15  N   UNL     1       3.056  -0.678  -0.204  1.00  0.00           N  
HETATM   16  CA  UNL     1       2.595   0.559   0.204  1.00  0.00           C  
HETATM   17  C   UNL     1       1.245   0.499   0.364  1.00  0.00           C  
HETATM   18  C   UNL     1       3.427   1.747   0.428  1.00  0.00           C  
HETATM   19  O   UNL     1       2.915   2.790   0.788  1.00  0.00           O  
HETATM   20  OXT UNL     1       4.761   1.683   0.235  1.00  0.00           O  
HETATM   21  N   UNL     1      -3.452   2.040  -0.979  1.00  0.00           N  
HETATM   22  H   UNL     1       0.571  -4.537  -0.945  1.00  0.00           H  
HETATM   23  H   UNL     1       2.760  -3.437  -0.934  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.460  -3.295  -0.339  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.720   0.711  -2.171  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.365   2.644  -2.765  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.037  -1.891   2.153  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.069  -0.655   2.764  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.855   1.217   1.393  1.00  0.00           H  
HETATM   30  H   UNL     1       3.982  -0.904  -0.388  1.00  0.00           H  
HETATM   31  H   UNL     1       0.604   1.310   0.676  1.00  0.00           H  
HETATM   32  HXT UNL     1       5.267   2.491   0.395  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.185   2.675  -0.983  1.00  0.00           H  
CONECT    1    2    2    4   22                                       
CONECT    2   14    1    1   23                                       
CONECT    3   17   14   14    5                                       
CONECT    4    5    5    1   24                                       
CONECT    5    3    9    4    4                                       
CONECT    6    7    7    8   25                                       
CONECT    7   21    6    6   26                                       
CONECT    8    6   13   13    9                                       
CONECT    9    8    5   10   10                                       
CONECT   10    9    9   11   27                                       
CONECT   11   12   12   10   28                                       
CONECT   12   13   11   11   29                                       
CONECT   13   21    8    8   12                                       
CONECT   14   15    3    3    2                                       
CONECT   15   16   14   30                                            
CONECT   16   18   17   17   15                                       
CONECT   17   16   16    3   31                                       
CONECT   18   19   19   20   16                                       
CONECT   19   18   18                                                 
CONECT   20   18   32                                                 
CONECT   21    7   13   33                                            
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   15                                                      
CONECT   31   17                                                      
CONECT   32   20                                                      
CONECT   33   21                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
