COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.649   0.058   2.601  1.00  0.00           N  
HETATM    2  CA  UNL     1       0.778   0.254   2.550  1.00  0.00           C  
HETATM    3  C   UNL     1       1.133   1.494   1.741  1.00  0.00           C  
HETATM    4  O   UNL     1       0.492   1.857   0.760  1.00  0.00           O  
HETATM    5  C   UNL     1       1.484  -0.975   1.962  1.00  0.00           C  
HETATM    6  C   UNL     1       2.940  -1.060   2.353  1.00  0.00           C  
HETATM    7  C   UNL     1       3.895  -0.457   1.549  1.00  0.00           C  
HETATM    8  C   UNL     1       3.294  -1.738   3.508  1.00  0.00           C  
HETATM    9  C   UNL     1       5.240  -0.535   1.911  1.00  0.00           C  
HETATM   10  C   UNL     1       4.639  -1.816   3.870  1.00  0.00           C  
HETATM   11  C   UNL     1       5.612  -1.215   3.071  1.00  0.00           C  
HETATM   12  O   UNL     1       6.920  -1.305   3.445  1.00  0.00           O  
HETATM   13  N   UNL     1       6.218   0.083   1.084  1.00  0.00           N1+
HETATM   14  O   UNL     1       5.844   0.685   0.050  1.00  0.00           O1-
HETATM   15  O   UNL     1       7.425   0.010   1.415  1.00  0.00           O  
HETATM   16  OXT UNL     1       2.212   2.177   2.192  1.00  0.00           O  
HETATM   17  H1  UNL     1      -1.168   0.442   3.373  1.00  0.00           H  
HETATM   18  H2  UNL     1      -1.071  -0.620   1.989  1.00  0.00           H  
HETATM   19  HA  UNL     1       1.097   0.444   3.581  1.00  0.00           H  
HETATM   20  H   UNL     1       0.988  -1.897   2.295  1.00  0.00           H  
HETATM   21  H   UNL     1       1.393  -0.976   0.868  1.00  0.00           H  
HETATM   22  H   UNL     1       3.599   0.072   0.646  1.00  0.00           H  
HETATM   23  H   UNL     1       2.544  -2.209   4.137  1.00  0.00           H  
HETATM   24  H   UNL     1       4.922  -2.346   4.775  1.00  0.00           H  
HETATM   25  H   UNL     1       7.238  -2.213   3.331  1.00  0.00           H  
HETATM   26  HXT UNL     1       2.437   2.979   1.675  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   23                                       
CONECT    9    7   11   11   13                                       
CONECT   10    8    8   11   24                                       
CONECT   11    9    9   10   12                                       
CONECT   12   11   25                                                 
CONECT   13    9   14   15   15                                       
CONECT   14   13                                                      
CONECT   15   13   13                                                 
CONECT   16    3   26                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24   10                                                      
CONECT   25   12                                                      
CONECT   26   16                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
