COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.916  -0.396   0.715  1.00  0.00           C  
HETATM    2  C   UNL     1       0.068   0.667   0.965  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.815  -0.701   0.392  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.962  -1.769   0.146  1.00  0.00           C  
HETATM    5  C   UNL     1       0.401  -1.612   0.303  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.947   0.179  -0.189  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.411   0.052  -0.245  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.152   1.075  -0.663  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.414   1.219  -0.526  1.00  0.00           O  
HETATM   10  N   UNL     1      -3.196  -0.857   0.234  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.295   0.519   0.805  1.00  0.00           C  
HETATM   12  C   UNL     1       2.404  -0.229   0.885  1.00  0.00           C  
HETATM   13  CA  UNL     1       3.017   0.247  -0.434  1.00  0.00           C  
HETATM   14  N   UNL     1       2.858  -0.798  -1.454  1.00  0.00           N  
HETATM   15  C   UNL     1       4.483   0.533  -0.232  1.00  0.00           C  
HETATM   16  O   UNL     1       5.309  -0.280  -0.573  1.00  0.00           O  
HETATM   17  H   UNL     1       0.474   1.616   1.286  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.364  -2.721  -0.168  1.00  0.00           H  
HETATM   19  H   UNL     1       1.066  -2.440   0.104  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.885  -0.871   0.054  1.00  0.00           H  
HETATM   21  H   UNL     1      -5.679   1.998  -0.961  1.00  0.00           H  
HETATM   22  H   UNL     1      -7.227   0.981  -0.703  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.613  -1.710   0.429  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.956   1.351   0.997  1.00  0.00           H  
HETATM   25  H   UNL     1       2.600   0.508   1.663  1.00  0.00           H  
HETATM   26  H   UNL     1       2.847  -1.183   1.168  1.00  0.00           H  
HETATM   27  HA  UNL     1       2.512   1.155  -0.763  1.00  0.00           H  
HETATM   28  H1  UNL     1       3.197  -0.483  -2.350  1.00  0.00           H  
HETATM   29  H2  UNL     1       3.318  -1.651  -1.172  1.00  0.00           H  
HETATM   30  OXT UNL     1       4.871   1.689   0.328  1.00  0.00           O  
HETATM   31  HXT UNL     1       5.821   1.827   0.437  1.00  0.00           H  
CONECT    1    2    2    5   12                                       
CONECT    2   11    1    1   17                                       
CONECT    3   10   11   11    4                                       
CONECT    4    3    5    5   18                                       
CONECT    5    4    4    1   19                                       
CONECT    6    9    9    7   10                                       
CONECT    7    8    8    6   20                                       
CONECT    8    7    7   21   22                                       
CONECT    9    6    6                                                 
CONECT   10    6    3   23                                            
CONECT   11    3    3    2   24                                       
CONECT   12    1   13   25   26                                       
CONECT   13   14   12   15   27                                       
CONECT   14   13   28   29                                            
CONECT   15   13   16   16   30                                       
CONECT   16   15   15                                                 
CONECT   17    2                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   15   31                                                 
CONECT   31   30                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
