COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.643  -1.519   0.728  1.00  0.00           O  
HETATM    2  C   UNL     1       6.004  -1.163  -0.233  1.00  0.00           C  
HETATM    3  OXT UNL     1       6.598  -1.053  -1.431  1.00  0.00           O  
HETATM    4  CA  UNL     1       4.537  -0.847  -0.087  1.00  0.00           C  
HETATM    5  N   UNL     1       4.019  -1.482   1.132  1.00  0.00           N  
HETATM    6  C   UNL     1       4.349   0.668   0.008  1.00  0.00           C  
HETATM    7  C   UNL     1       2.877   0.991   0.030  1.00  0.00           C  
HETATM    8  C   UNL     1       2.200   1.207  -1.156  1.00  0.00           C  
HETATM    9  C   UNL     1       0.849   1.498  -1.139  1.00  0.00           C  
HETATM   10 CL   UNL     1      -0.001   1.769  -2.629  1.00  0.00          Cl  
HETATM   11  C   UNL     1       2.205   1.064   1.236  1.00  0.00           C  
HETATM   12  C   UNL     1       0.855   1.360   1.260  1.00  0.00           C  
HETATM   13 CL   UNL     1       0.012   1.452   2.775  1.00  0.00          Cl  
HETATM   14  C   UNL     1       0.171   1.572   0.071  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.158   1.859   0.090  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.035   0.822   0.030  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.400   1.066   0.047  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.292   0.012  -0.014  1.00  0.00           C  
HETATM   19 CL   UNL     1      -6.001   0.318   0.008  1.00  0.00          Cl  
HETATM   20  C   UNL     1      -1.564  -0.481  -0.055  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.456  -1.535  -0.122  1.00  0.00           C  
HETATM   22 CL   UNL     1      -1.867  -3.165  -0.221  1.00  0.00          Cl  
HETATM   23  C   UNL     1      -3.821  -1.291  -0.094  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.699  -2.329  -0.160  1.00  0.00           O  
HETATM   25  HXT UNL     1       7.539  -1.270  -1.476  1.00  0.00           H  
HETATM   26  HA  UNL     1       3.996  -1.227  -0.953  1.00  0.00           H  
HETATM   27  H1  UNL     1       4.073  -2.487   1.067  1.00  0.00           H  
HETATM   28  H2  UNL     1       4.505  -1.146   1.950  1.00  0.00           H  
HETATM   29  H   UNL     1       4.815   1.036   0.922  1.00  0.00           H  
HETATM   30  H   UNL     1       4.813   1.146  -0.855  1.00  0.00           H  
HETATM   31  H   UNL     1       2.728   1.150  -2.096  1.00  0.00           H  
HETATM   32  H   UNL     1       2.736   0.890   2.161  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.766   2.080   0.109  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.501  -0.671  -0.069  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.945  -2.691   0.702  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2   25                                                 
CONECT    4    6    5    2   26                                       
CONECT    5    4   27   28                                            
CONECT    6    7    4   29   30                                       
CONECT    7    8    8   11    6                                       
CONECT    8    9    7    7   31                                       
CONECT    9   10   14   14    8                                       
CONECT   10    9                                                      
CONECT   11   12   12    7   32                                       
CONECT   12   14   13   11   11                                       
CONECT   13   12                                                      
CONECT   14   15    9    9   12                                       
CONECT   15   16   14                                                 
CONECT   16   20   20   17   15                                       
CONECT   17   18   18   16   33                                       
CONECT   18   23   19   17   17                                       
CONECT   19   18                                                      
CONECT   20   21   16   16   34                                       
CONECT   21   22   23   23   20                                       
CONECT   22   21                                                      
CONECT   23   21   21   24   18                                       
CONECT   24   23   35                                                 
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32   11                                                      
CONECT   33   17                                                      
CONECT   34   20                                                      
CONECT   35   24                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
