COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.753   0.509  -0.106  1.00  0.00           C  
HETATM    2  C   UNL     1       3.638   1.261  -0.417  1.00  0.00           C  
HETATM    3  CA  UNL     1      -2.521   0.408  -0.184  1.00  0.00           C  
HETATM    4  C   UNL     1       2.232  -0.503   0.065  1.00  0.00           C  
HETATM    5  C   UNL     1       3.309  -1.317   0.400  1.00  0.00           C  
HETATM    6  C   UNL     1       4.592  -0.807   0.308  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.924  -0.137  -0.096  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.118  -0.193  -0.070  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.521  -0.704   0.137  1.00  0.00           C  
HETATM   10  N   UNL     1       0.934  -1.005   0.154  1.00  0.00           N  
HETATM   11  N   UNL     1      -2.361   1.504   0.781  1.00  0.00           N  
HETATM   12  N   UNL     1       2.427   0.746  -0.325  1.00  0.00           N  
HETATM   13  O   UNL     1      -4.589   0.063   0.893  1.00  0.00           O  
HETATM   14  OXT UNL     1      -4.434  -0.844  -1.117  1.00  0.00           O  
HETATM   15  O   UNL     1       0.063   0.948  -0.438  1.00  0.00           O  
HETATM   16  H   UNL     1       5.741   0.937  -0.188  1.00  0.00           H  
HETATM   17  H   UNL     1       3.759   2.285  -0.740  1.00  0.00           H  
HETATM   18  HA  UNL     1      -2.339   0.782  -1.191  1.00  0.00           H  
HETATM   19  H   UNL     1       3.146  -2.333   0.727  1.00  0.00           H  
HETATM   20  H   UNL     1       5.448  -1.418   0.553  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.645  -1.016   1.174  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.699  -1.554  -0.522  1.00  0.00           H  
HETATM   23  H   UNL     1       0.789  -1.938   0.376  1.00  0.00           H  
HETATM   24  H1  UNL     1      -2.525   1.184   1.723  1.00  0.00           H  
HETATM   25  H2  UNL     1      -1.449   1.929   0.697  1.00  0.00           H  
HETATM   26  HXT UNL     1      -5.337  -1.173  -1.015  1.00  0.00           H  
CONECT    1    2    2    6   16                                       
CONECT    2    1    1   12   17                                       
CONECT    3    7   11    9   18                                       
CONECT    4   12   12    5   10                                       
CONECT    5    6    6    4   19                                       
CONECT    6    1    5    5   20                                       
CONECT    7   13   13   14    3                                       
CONECT    8   15   15   10    9                                       
CONECT    9    8    3   21   22                                       
CONECT   10    4    8   23                                            
CONECT   11    3   24   25                                            
CONECT   12    2    4    4                                            
CONECT   13    7    7                                                 
CONECT   14    7   26                                                 
CONECT   15    8    8                                                 
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    9                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   14                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
