COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.081   7.687   0.938  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.262   6.665   1.275  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.608   7.648  -0.306  1.00  0.00           C  
HETATM    4  C   UNL     1       0.314   6.719   2.652  1.00  0.00           C  
HETATM    5  C   UNL     1       0.051   5.611   0.432  1.00  0.00           C  
HETATM    6  O   UNL     1       0.883   4.615   0.837  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.514   5.617  -0.831  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.211   4.519  -1.765  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.358   6.640  -1.224  1.00  0.00           C  
HETATM   10  N   UNL     1       0.052   3.329  -1.354  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.990   6.690  -2.572  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.138   7.394  -3.469  1.00  0.00           O  
HETATM   13  P   UNL     1      -1.620   7.575  -5.001  1.00  0.00           P  
HETATM   14  O   UNL     1      -1.921   6.054  -5.462  1.00  0.00           O  
HETATM   15  O   UNL     1      -0.668   8.328  -5.883  1.00  0.00           O  
HETATM   16  O   UNL     1      -3.097   8.221  -4.867  1.00  0.00           O  
HETATM   17  CA  UNL     1       0.324   2.395  -2.452  1.00  0.00           C  
HETATM   18  C   UNL     1       1.821   2.387  -2.786  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.201   1.039  -2.036  1.00  0.00           C  
HETATM   20  C   UNL     1       2.750   1.911  -1.657  1.00  0.00           C  
HETATM   21  C   UNL     1       4.203   1.908  -2.115  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.683   0.774  -0.942  1.00  0.00           O  
HETATM   23  OXT UNL     1      -0.086   0.120  -3.030  1.00  0.00           O  
HETATM   24  O   UNL     1       2.426   0.582  -1.262  1.00  0.00           O  
HETATM   25  H   UNL     1      -2.261   8.481  -0.548  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.288   6.114   3.340  1.00  0.00           H  
HETATM   27  H   UNL     1       1.344   6.343   2.665  1.00  0.00           H  
HETATM   28  H   UNL     1       0.345   7.749   3.028  1.00  0.00           H  
HETATM   29  H   UNL     1       0.463   3.750   0.704  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.223   4.768  -2.843  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.162   5.681  -2.973  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.963   7.200  -2.537  1.00  0.00           H  
HETATM   33  HA  UNL     1      -0.254   2.731  -3.321  1.00  0.00           H  
HETATM   34  H   UNL     1       2.109   3.407  -3.075  1.00  0.00           H  
HETATM   35  H   UNL     1       1.980   1.747  -3.663  1.00  0.00           H  
HETATM   36  H   UNL     1       2.662   2.559  -0.778  1.00  0.00           H  
HETATM   37  H   UNL     1       4.528   2.925  -2.360  1.00  0.00           H  
HETATM   38  H   UNL     1       4.326   1.311  -3.026  1.00  0.00           H  
HETATM   39  H   UNL     1       4.864   1.508  -1.340  1.00  0.00           H  
HETATM   40  HXT UNL     1      -0.418  -0.777  -2.812  1.00  0.00           H  
HETATM   41  H   UNL     1       3.131   0.292  -0.661  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.574   8.486  -5.681  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.146   5.878  -6.400  1.00  0.00           H  
CONECT    1    2    2    3                                            
CONECT    2    1    1    4    5                                       
CONECT    3    1    9    9   25                                       
CONECT    4    2   26   27   28                                       
CONECT    5    2    6    7    7                                       
CONECT    6    5   29                                                 
CONECT    7    5    5    8    9                                       
CONECT    8    7   10   10   30                                       
CONECT    9    3    3    7   11                                       
CONECT   10    8    8   17                                            
CONECT   11    9   12   31   32                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   15   15                                       
CONECT   13   16                                                      
CONECT   14   13   43                                                 
CONECT   15   13   13                                                 
CONECT   16   13   42                                                 
CONECT   17   10   18   19   33                                       
CONECT   18   17   20   34   35                                       
CONECT   19   17   22   22   23                                       
CONECT   20   18   21   24   36                                       
CONECT   21   20   37   38   39                                       
CONECT   22   19   19                                                 
CONECT   23   19   40                                                 
CONECT   24   20   41                                                 
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   16                                                      
CONECT   43   14                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
