COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.557   1.676   3.428  1.00  0.00           N  
HETATM    2  CA  UNL     1      -1.533   0.358   2.780  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.125  -0.233   2.879  1.00  0.00           C  
HETATM    4  C   UNL     1       0.846   0.623   2.065  1.00  0.00           C  
HETATM    5  C   UNL     1       2.251   0.228   2.461  1.00  0.00           C  
HETATM    6  O   UNL     1       2.615   0.306   3.618  1.00  0.00           O  
HETATM    7  C   UNL     1       0.459   0.501   0.609  1.00  0.00           C  
HETATM    8  C   UNL     1       3.124  -0.228   1.467  1.00  0.00           C  
HETATM    9  C   UNL     1       1.366   0.053  -0.266  1.00  0.00           C  
HETATM   10  C   UNL     1       2.718  -0.318   0.160  1.00  0.00           C  
HETATM   11  O   UNL     1       3.594  -0.766  -0.765  1.00  0.00           O  
HETATM   12  N   UNL     1       1.017  -0.062  -1.616  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.271   0.289  -2.039  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.617   0.174  -3.380  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.899   0.526  -3.793  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.230   0.407  -5.131  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.265  -0.060  -6.014  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.014  -0.391  -5.534  1.00  0.00           C  
HETATM   19  N   UNL     1       0.275  -0.263  -4.253  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.512  -0.557   3.469  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.752  -0.411   4.644  1.00  0.00           O  
HETATM   22  OXT UNL     1      -3.117  -1.535   2.776  1.00  0.00           O  
HETATM   23  H1  UNL     1      -0.894   2.254   2.933  1.00  0.00           H  
HETATM   24  H2  UNL     1      -1.191   1.548   4.359  1.00  0.00           H  
HETATM   25  HA  UNL     1      -1.809   0.463   1.731  1.00  0.00           H  
HETATM   26  H   UNL     1       0.189  -0.248   3.923  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.130  -1.249   2.487  1.00  0.00           H  
HETATM   28  H   UNL     1       0.697   1.661   2.363  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.533   0.772   0.281  1.00  0.00           H  
HETATM   30  H   UNL     1       4.131  -0.515   1.732  1.00  0.00           H  
HETATM   31  H   UNL     1       4.420  -0.958  -0.299  1.00  0.00           H  
HETATM   32  H   UNL     1       1.667  -0.386  -2.259  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.921   0.613  -1.396  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.625   0.886  -3.080  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.217   0.672  -5.481  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.492  -0.165  -7.064  1.00  0.00           H  
HETATM   37  H   UNL     1       0.738  -0.755  -6.218  1.00  0.00           H  
HETATM   38  HXT UNL     1      -3.746  -2.122   3.218  1.00  0.00           H  
CONECT    1    2   23   24                                            
CONECT    2    1    3   20   25                                       
CONECT    3    2    4   26   27                                       
CONECT    4    3    5    7   28                                       
CONECT    5    4    6    6    8                                       
CONECT    6    5    5                                                 
CONECT    7    4    9    9   29                                       
CONECT    8    5   10   10   30                                       
CONECT    9    7    7   10   12                                       
CONECT   10    8    8    9   11                                       
CONECT   11   10   31                                                 
CONECT   12    9   13   32                                            
CONECT   13   12   14   33                                            
CONECT   14   13   15   19   19                                       
CONECT   15   14   16   16   34                                       
CONECT   16   15   15   17   35                                       
CONECT   17   16   18   18   36                                       
CONECT   18   17   17   19   37                                       
CONECT   19   14   14   18                                            
CONECT   20    2   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   38                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   22                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
