COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.992  -2.255  -0.141  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.619  -1.214  -0.138  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.966  -1.238  -0.180  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.906   0.074  -0.081  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.593   1.272  -0.238  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.919   2.484  -0.184  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.575   2.550   0.022  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.817   1.379   0.188  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.428   1.431   0.401  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.464   0.119   0.147  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.713  -1.050   0.318  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.369  -0.963   0.528  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.728   0.274   0.557  1.00  0.00           C  
HETATM   14  C   UNL     1       0.760   0.333   0.792  1.00  0.00           C  
HETATM   15  C   UNL     1       1.490   0.269  -0.551  1.00  0.00           C  
HETATM   16  C   UNL     1       2.978   0.329  -0.317  1.00  0.00           C  
HETATM   17  C   UNL     1       3.682   1.617  -0.276  1.00  0.00           C  
HETATM   18  O   UNL     1       3.074   2.659  -0.431  1.00  0.00           O  
HETATM   19  N   UNL     1       5.014   1.624  -0.063  1.00  0.00           N  
HETATM   20  C   UNL     1       5.682   0.470   0.108  1.00  0.00           C  
HETATM   21  O   UNL     1       6.884   0.503   0.294  1.00  0.00           O  
HETATM   22  N   UNL     1       5.059  -0.720   0.075  1.00  0.00           N  
HETATM   23  CA  UNL     1       3.699  -0.808  -0.132  1.00  0.00           C  
HETATM   24  C   UNL     1       3.032  -2.131  -0.165  1.00  0.00           C  
HETATM   25  O   UNL     1       1.822  -2.199  -0.238  1.00  0.00           O  
HETATM   26  OXT UNL     1       3.767  -3.258  -0.115  1.00  0.00           O  
HETATM   27  H   UNL     1      -7.389  -2.107  -0.212  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.660   1.260  -0.403  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.476   3.401  -0.309  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.086   3.513   0.058  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.920   2.383   0.440  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.195  -2.015   0.284  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.790  -1.865   0.660  1.00  0.00           H  
HETATM   34  H   UNL     1       1.011   1.265   1.298  1.00  0.00           H  
HETATM   35  H   UNL     1       1.064  -0.510   1.411  1.00  0.00           H  
HETATM   36  H   UNL     1       1.239  -0.663  -1.057  1.00  0.00           H  
HETATM   37  H   UNL     1       1.186   1.113  -1.171  1.00  0.00           H  
HETATM   38  H   UNL     1       5.493   2.467  -0.033  1.00  0.00           H  
HETATM   39  H   UNL     1       5.575  -1.532   0.202  1.00  0.00           H  
HETATM   40  HXT UNL     1       3.287  -4.097  -0.139  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    4    3                                       
CONECT    3    2   27                                                 
CONECT    4    2   10   10    5                                       
CONECT    5    4    6    6   28                                       
CONECT    6    5    5    7   29                                       
CONECT    7    8    8    6   30                                       
CONECT    8   10    9    7    7                                       
CONECT    9   13   13    8   31                                       
CONECT   10   11    4    4    8                                       
CONECT   11   12   12   10   32                                       
CONECT   12   11   11   13   33                                       
CONECT   13   12   14    9    9                                       
CONECT   14   15   13   34   35                                       
CONECT   15   16   14   36   37                                       
CONECT   16   23   23   17   15                                       
CONECT   17   19   16   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   38                                            
CONECT   20   21   21   22   19                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   39                                            
CONECT   23   22   24   16   16                                       
CONECT   24   25   25   26   23                                       
CONECT   25   24   24                                                 
CONECT   26   24   40                                                 
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   19                                                      
CONECT   39   22                                                      
CONECT   40   26                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
