COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  OXT THR A   1      -8.741  -0.129  -0.293  1.00  0.00           O  
ATOM      2  C   THR A   1      -7.425  -0.048  -0.544  1.00  0.00           C  
ATOM      3  O   THR A   1      -6.892  -0.872  -1.249  1.00  0.00           O  
ATOM      4  CA  THR A   1      -6.612   1.071   0.055  1.00  0.00           C  
ATOM      5  CB  THR A   1      -7.163   2.415  -0.425  1.00  0.00           C  
ATOM      6  CG2 THR A   1      -6.263   3.544   0.081  1.00  0.00           C  
ATOM      7  OG1 THR A   1      -7.195   2.434  -1.853  1.00  0.00           O  
ATOM      8  N   THR A   1      -5.215   0.938  -0.366  1.00  0.00           N  
HETATM    9  C   UNK A   0      -4.378   0.135   0.321  1.00  0.00           C  
HETATM   10  O   UNK A   0      -3.094   0.013  -0.066  1.00  0.00           O  
HETATM   11  O   UNK A   0      -4.782  -0.478   1.289  1.00  0.00           O  
HETATM   12  P   UNK A   0      -2.158  -0.965   0.806  1.00  0.00           P  
HETATM   13  O   UNK A   0      -1.997  -0.369   2.293  1.00  0.00           O  
HETATM   14  O   UNK A   0      -2.777  -2.307   0.877  1.00  0.00           O  
HETATM   15  O   UNK A   0      -0.709  -1.078   0.114  1.00  0.00           O  
HETATM   16  C   UNK A   0       0.315  -1.954   0.591  1.00  0.00           C  
HETATM   17  C   UNK A   0       1.558  -1.814  -0.291  1.00  0.00           C  
HETATM   18  C   UNK A   0       2.633  -2.841   0.128  1.00  0.00           C  
HETATM   19  O   UNK A   0       2.597  -3.982  -0.730  1.00  0.00           O  
HETATM   20  C   UNK A   0       3.966  -2.078  -0.041  1.00  0.00           C  
HETATM   21  O   UNK A   0       4.795  -2.727  -1.007  1.00  0.00           O  
HETATM   22  C   UNK A   0       3.539  -0.681  -0.542  1.00  0.00           C  
HETATM   23  O   UNK A   0       2.177  -0.526  -0.085  1.00  0.00           O  
HETATM   24  N   UNK A   0       4.394   0.355   0.043  1.00  0.00           N  
HETATM   25  C   UNK A   0       4.127   1.084   1.163  1.00  0.00           C  
HETATM   26  N   UNK A   0       5.102   1.914   1.396  1.00  0.00           N  
HETATM   27  C   UNK A   0       6.054   1.770   0.443  1.00  0.00           C  
HETATM   28  C   UNK A   0       7.294   2.378   0.185  1.00  0.00           C  
HETATM   29  N   UNK A   0       7.782   3.371   1.017  1.00  0.00           N  
HETATM   30  N   UNK A   0       7.988   1.978  -0.875  1.00  0.00           N  
HETATM   31  C   UNK A   0       7.531   1.031  -1.674  1.00  0.00           C  
HETATM   32  N   UNK A   0       6.375   0.434  -1.472  1.00  0.00           N  
HETATM   33  C   UNK A   0       5.614   0.764  -0.434  1.00  0.00           C  
ATOM     34  HXT THR A   1      -9.221  -0.864  -0.699  1.00  0.00           H  
ATOM     35  HA  THR A   1      -6.670   1.021   1.142  1.00  0.00           H  
ATOM     36  HB  THR A   1      -8.172   2.553  -0.037  1.00  0.00           H  
ATOM     37 HG21 THR A   1      -5.254   3.406  -0.307  1.00  0.00           H  
ATOM     38 HG22 THR A   1      -6.656   4.502  -0.261  1.00  0.00           H  
ATOM     39 HG23 THR A   1      -6.239   3.530   1.171  1.00  0.00           H  
ATOM     40  HG1 THR A   1      -6.329   2.317  -2.268  1.00  0.00           H  
ATOM     41  H   THR A   1      -4.892   1.427  -1.139  1.00  0.00           H  
HETATM   42  H   UNK A   0      -1.597   0.511   2.323  1.00  0.00           H  
HETATM   43  H   UNK A   0       0.568  -1.693   1.618  1.00  0.00           H  
HETATM   44  H   UNK A   0      -0.041  -2.984   0.555  1.00  0.00           H  
HETATM   45  H   UNK A   0       1.294  -1.947  -1.340  1.00  0.00           H  
HETATM   46  H   UNK A   0       2.491  -3.140   1.167  1.00  0.00           H  
HETATM   47  H   UNK A   0       3.252  -4.659  -0.512  1.00  0.00           H  
HETATM   48  H   UNK A   0       4.485  -1.999   0.914  1.00  0.00           H  
HETATM   49  H   UNK A   0       5.044  -3.631  -0.768  1.00  0.00           H  
HETATM   50  H   UNK A   0       3.582  -0.638  -1.630  1.00  0.00           H  
HETATM   51  H   UNK A   0       3.237   0.988   1.767  1.00  0.00           H  
HETATM   52  H   UNK A   0       7.267   3.655   1.788  1.00  0.00           H  
HETATM   53  H   UNK A   0       8.640   3.783   0.829  1.00  0.00           H  
HETATM   54  H   UNK A   0       8.127   0.736  -2.524  1.00  0.00           H  
CONECT    1    2   34                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    8   35                                       
CONECT    5    7    4    6   36                                       
CONECT    6    5   37   38   39                                       
CONECT    7    5   40                                                 
CONECT    8    4    9   41                                            
CONECT    9    8   11   11   10                                       
CONECT   10    9   12                                                 
CONECT   11    9    9                                                 
CONECT   12   10   14   14   15                                       
CONECT   12   13                                                      
CONECT   13   12   42                                                 
CONECT   14   12   12                                                 
CONECT   15   12   16                                                 
CONECT   16   17   15   43   44                                       
CONECT   17   23   16   18   45                                       
CONECT   18   17   20   19   46                                       
CONECT   19   18   47                                                 
CONECT   20   22   21   18   48                                       
CONECT   21   20   49                                                 
CONECT   22   23   24   20   50                                       
CONECT   23   22   17                                                 
CONECT   24   22   33   25                                            
CONECT   25   24   26   26   51                                       
CONECT   26   25   25   27                                            
CONECT   27   33   33   28   26                                       
CONECT   28   30   30   27   29                                       
CONECT   29   28   52   53                                            
CONECT   30   31   28   28                                            
CONECT   31   32   32   30   54                                       
CONECT   32   31   31   33                                            
CONECT   33   32   24   27   27                                       
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   25                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
