COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.543   0.211   0.093  1.00  0.00           C  
HETATM    2  C   UNL     1       4.240  -0.172   0.797  1.00  0.00           C  
HETATM    3  C   UNL     1       3.055   0.139  -0.120  1.00  0.00           C  
HETATM    4  C   UNL     1       1.751  -0.244   0.584  1.00  0.00           C  
HETATM    5  C   UNL     1       0.566   0.066  -0.332  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.741  -0.199   0.417  1.00  0.00           C  
HETATM    7  CA  UNL     1      -1.924   0.228  -0.454  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.213  -0.145   0.231  1.00  0.00           C  
HETATM    9  C   UNL     1       0.633  -0.827  -1.573  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.881   1.683  -0.658  1.00  0.00           N  
HETATM   11  O   UNL     1      -3.839   0.692   0.837  1.00  0.00           O  
HETATM   12  OXT UNL     1      -3.666  -1.407   0.167  1.00  0.00           O  
HETATM   13  H   UNL     1       5.639  -0.360  -0.831  1.00  0.00           H  
HETATM   14  H   UNL     1       5.532   1.276  -0.139  1.00  0.00           H  
HETATM   15  H   UNL     1       6.387  -0.010   0.746  1.00  0.00           H  
HETATM   16  H   UNL     1       4.251  -1.237   1.028  1.00  0.00           H  
HETATM   17  H   UNL     1       4.144   0.399   1.720  1.00  0.00           H  
HETATM   18  H   UNL     1       3.043   1.204  -0.351  1.00  0.00           H  
HETATM   19  H   UNL     1       3.150  -0.433  -1.043  1.00  0.00           H  
HETATM   20  H   UNL     1       1.763  -1.309   0.816  1.00  0.00           H  
HETATM   21  H   UNL     1       1.656   0.327   1.508  1.00  0.00           H  
HETATM   22  H   UNL     1       0.606   1.112  -0.635  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.821  -1.263   0.642  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.749   0.370   1.346  1.00  0.00           H  
HETATM   25  HA  UNL     1      -1.866  -0.276  -1.419  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.211  -0.606  -2.226  1.00  0.00           H  
HETATM   27  H   UNL     1       1.565  -0.638  -2.106  1.00  0.00           H  
HETATM   28  H   UNL     1       0.594  -1.873  -1.270  1.00  0.00           H  
HETATM   29  H1  UNL     1      -1.934   2.173   0.222  1.00  0.00           H  
HETATM   30  H2  UNL     1      -1.056   1.951  -1.173  1.00  0.00           H  
HETATM   31  HXT UNL     1      -4.497  -1.599   0.622  1.00  0.00           H  
CONECT    1    2   13   14   15                                       
CONECT    2    3    1   16   17                                       
CONECT    3    4    2   18   19                                       
CONECT    4    5    3   20   21                                       
CONECT    5    9    6    4   22                                       
CONECT    6    7    5   23   24                                       
CONECT    7    8    6   10   25                                       
CONECT    8    7   11   11   12                                       
CONECT    9    5   26   27   28                                       
CONECT   10    7   29   30                                            
CONECT   11    8    8                                                 
CONECT   12    8   31                                                 
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   12                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
