COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.615   1.253   0.897  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.335   0.052   0.452  1.00  0.00           C  
HETATM    3  C   UNL     1       3.751   0.421   0.091  1.00  0.00           C  
HETATM    4  O   UNL     1       4.031   1.569  -0.158  1.00  0.00           O  
HETATM    5  C   UNL     1       1.633  -0.538  -0.773  1.00  0.00           C  
HETATM    6  C   UNL     1       0.260  -1.019  -0.382  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.078  -2.269  -0.029  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.960  -0.209  -0.309  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.415  -2.327   0.260  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.983  -1.083   0.098  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.245   1.137  -0.549  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.276  -0.594   0.258  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.519   1.601  -0.387  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.538   0.741   0.015  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.801   1.219   0.171  1.00  0.00           O  
HETATM   16  OXT UNL     1       4.700  -0.527   0.045  1.00  0.00           O  
HETATM   17  H1  UNL     1       2.021   1.625   1.743  1.00  0.00           H  
HETATM   18  H2  UNL     1       1.592   1.952   0.170  1.00  0.00           H  
HETATM   19  HA  UNL     1       2.345  -0.684   1.255  1.00  0.00           H  
HETATM   20  H   UNL     1       1.544   0.227  -1.544  1.00  0.00           H  
HETATM   21  H   UNL     1       2.216  -1.375  -1.157  1.00  0.00           H  
HETATM   22  H   UNL     1       0.604  -3.105   0.021  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.891  -3.125   0.539  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.459   1.809  -0.861  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.071  -1.255   0.569  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.738   2.642  -0.573  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.991   1.545   1.061  1.00  0.00           H  
HETATM   28  HXT UNL     1       5.594  -0.242  -0.191  1.00  0.00           H  
CONECT    1    2   17   18                                            
CONECT    2    1    3    5   19                                       
CONECT    3    2    4    4   16                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   20   21                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6    9   22                                       
CONECT    8    6   10   10   11                                       
CONECT    9    7   10   23                                            
CONECT   10    8    8    9   12                                       
CONECT   11    8   13   13   24                                       
CONECT   12   10   14   14   25                                       
CONECT   13   11   11   14   26                                       
CONECT   14   12   12   13   15                                       
CONECT   15   14   27                                                 
CONECT   16    3   28                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
