COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.209  -0.973   0.627  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.407   0.470  -0.132  1.00  0.00           N  
HETATM    3  O   UNL     1      -3.797  -1.715   1.579  1.00  0.00           O  
HETATM    4  CA  UNL     1      -1.727  -0.705   0.689  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.970  -1.913   0.156  1.00  0.00           C  
HETATM    6  C   UNL     1       0.547  -1.672   0.181  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.307   4.481  -0.288  1.00  0.00           O  
HETATM    8  O   UNL     1       2.919  -2.079   0.486  1.00  0.00           O  
HETATM    9  O   UNL     1      -1.856   2.891  -0.355  1.00  0.00           O  
HETATM   10  O   UNL     1       4.426  -0.603   0.562  1.00  0.00           O1-
HETATM   11  C   UNL     1       1.679   2.470   0.063  1.00  0.00           C  
HETATM   12  C   UNL     1       2.616   1.474   0.230  1.00  0.00           C  
HETATM   13  C   UNL     1       0.082  -2.549  -1.923  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.237  -2.076  -1.357  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.682   3.187  -0.245  1.00  0.00           C  
HETATM   16  C   UNL     1       0.330   2.132  -0.064  1.00  0.00           C  
HETATM   17  C   UNL     1       2.228   0.147   0.269  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.059   0.781  -0.019  1.00  0.00           C  
HETATM   19  N   UNL     1       3.251  -0.907   0.450  1.00  0.00           N1+
HETATM   20  C   UNL     1       1.058  -2.331  -1.083  1.00  0.00           C  
HETATM   21  C   UNL     1       0.894  -0.210   0.143  1.00  0.00           C  
HETATM   22  OXT UNL     1      -3.867  -0.524  -0.281  1.00  0.00           O  
HETATM   23  H   UNL     1      -1.664   0.318  -1.096  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.750  -1.860   1.497  1.00  0.00           H  
HETATM   25  HA  UNL     1      -1.434  -0.517   1.722  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.232  -2.813   0.711  1.00  0.00           H  
HETATM   27  H   UNL     1       0.986  -2.150   1.056  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.007   5.137  -0.408  1.00  0.00           H  
HETATM   29  H   UNL     1       1.986   3.505   0.030  1.00  0.00           H  
HETATM   30  H   UNL     1       3.660   1.732   0.331  1.00  0.00           H  
HETATM   31  H   UNL     1       0.202  -3.008  -2.894  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.014  -2.821  -1.528  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.521  -1.120  -1.799  1.00  0.00           H  
HETATM   34  H   UNL     1       2.092  -2.586  -1.266  1.00  0.00           H  
CONECT    1    3    4   22   22                                       
CONECT    2    4   18   23                                            
CONECT    3    1   24                                                 
CONECT    4    1    2    5   25                                       
CONECT    5    4    6   14   26                                       
CONECT    6    5   20   21   27                                       
CONECT    7   15   28                                                 
CONECT    8   19   19                                                 
CONECT    9   15   15                                                 
CONECT   10   19                                                      
CONECT   11   12   12   16   29                                       
CONECT   12   11   11   17   30                                       
CONECT   13   14   20   20   31                                       
CONECT   14    5   13   32   33                                       
CONECT   15    9    9    7   16                                       
CONECT   16   11   15   18   18                                       
CONECT   17   12   19   21   21                                       
CONECT   18   16   16    2   21                                       
CONECT   19   10   17    8    8                                       
CONECT   20    6   13   13   34                                       
CONECT   21   17   17   18    6                                       
CONECT   22    1    1                                                 
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   20                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
