COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.559   1.632  -0.124  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.304   0.260   0.336  1.00  0.00           C  
HETATM    3  C   UNL     1       3.477  -0.616  -0.021  1.00  0.00           C  
HETATM    4  O   UNL     1       4.246  -0.273  -0.887  1.00  0.00           O  
HETATM    5  C   UNL     1       1.041  -0.278  -0.340  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.151   0.523   0.114  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.007   1.432   0.897  1.00  0.00           O  
HETATM    8  O   UNL     1      -1.375   0.228  -0.352  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.477   1.042   0.128  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.782   0.559  -0.509  1.00  0.00           C  
HETATM   11 CL   UNL     1      -4.144  -1.115   0.056  1.00  0.00          Cl  
HETATM   12  OXT UNL     1       3.668  -1.778   0.624  1.00  0.00           O  
HETATM   13  H1  UNL     1       3.351   2.033   0.355  1.00  0.00           H  
HETATM   14  H2  UNL     1       2.691   1.659  -1.125  1.00  0.00           H  
HETATM   15  HA  UNL     1       2.166   0.260   1.417  1.00  0.00           H  
HETATM   16  H   UNL     1       1.145  -0.195  -1.421  1.00  0.00           H  
HETATM   17  H   UNL     1       0.901  -1.324  -0.067  1.00  0.00           H  
HETATM   18  HXT UNL     1       4.434  -2.306   0.361  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.548   0.955   1.212  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.305   2.083  -0.142  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.596   1.224  -0.219  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.680   0.563  -1.594  1.00  0.00           H  
CONECT    1    2   13   14                                            
CONECT    2    1    3    5   15                                       
CONECT    3    2    4    4   12                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   16   17                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9                                                 
CONECT    9    8   10   19   20                                       
CONECT   10    9   11   21   22                                       
CONECT   11   10                                                      
CONECT   12    3   18                                                 
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
CONECT   18   12                                                      
CONECT   19    9                                                      
CONECT   20    9                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
