COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.485  -0.820  -0.295  1.00  0.00           C  
HETATM    2  N   UNL     1       1.788   0.914  -0.297  1.00  0.00           N  
HETATM    3  O   UNL     1       4.205   0.023  -0.776  1.00  0.00           O  
HETATM    4  CA  UNL     1       2.055  -0.486   0.044  1.00  0.00           C  
HETATM    5  C   UNL     1       1.117  -1.393  -0.754  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.307  -1.144  -0.326  1.00  0.00           C  
HETATM    7  C   UNL     1       1.813   3.330   0.232  1.00  0.00           C  
HETATM    8  O   UNL     1       2.581   1.611   1.655  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.988   0.461   0.246  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.444   1.209  -0.797  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.250  -0.483   0.890  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.162   1.010  -1.208  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.129  -1.684   1.135  1.00  0.00           C  
HETATM   14  C   UNL     1       2.088   1.891   0.582  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.922  -0.717   0.494  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.370   0.039  -0.570  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.847  -1.884   0.723  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.043  -0.196  -0.967  1.00  0.00           C  
HETATM   19  OXT UNL     1       3.958  -2.056  -0.067  1.00  0.00           O  
HETATM   20  H   UNL     1       1.394   1.138  -1.154  1.00  0.00           H  
HETATM   21  HA  UNL     1       1.889  -0.638   1.110  1.00  0.00           H  
HETATM   22  H   UNL     1       1.219  -1.177  -1.818  1.00  0.00           H  
HETATM   23  H   UNL     1       1.375  -2.436  -0.569  1.00  0.00           H  
HETATM   24  H   UNL     1       2.685   3.757  -0.262  1.00  0.00           H  
HETATM   25  H   UNL     1       0.953   3.384  -0.437  1.00  0.00           H  
HETATM   26  H   UNL     1       1.600   3.891   1.142  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.008   0.640   0.552  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.049   1.958  -1.287  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.682  -1.049   1.702  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.754   1.596  -2.018  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.535  -2.266   1.950  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.240  -2.628   1.218  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.610   0.374  -1.776  1.00  0.00           H  
HETATM   34  HXT UNL     1       4.880  -2.224  -0.304  1.00  0.00           H  
CONECT    1    4    3    3   19                                       
CONECT    2   14    4   20                                            
CONECT    3    1    1                                                 
CONECT    4    1    2    5   21                                       
CONECT    5    4    6   22   23                                       
CONECT    6    5   17   17   18                                       
CONECT    7   14   24   25   26                                       
CONECT    8   14   14                                                 
CONECT    9   11   11   10   27                                       
CONECT   10    9   12   12   28                                       
CONECT   11    9    9   15   29                                       
CONECT   12   10   10   16   30                                       
CONECT   13   17   15   15   31                                       
CONECT   14    2    7    8    8                                       
CONECT   15   11   13   13   16                                       
CONECT   16   12   15   18   18                                       
CONECT   17    6    6   13   32                                       
CONECT   18    6   16   16   33                                       
CONECT   19    1   34                                                 
CONECT   20    2                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    5                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
