COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -9.468   1.389  -2.202  1.00  0.00           C  
HETATM    2  C   UNK A   0      -8.562   0.429  -2.615  1.00  0.00           C  
HETATM    3  C   UNK A   0      -7.617  -0.056  -1.733  1.00  0.00           C  
HETATM    4  C   UNK A   0      -7.576   0.424  -0.426  1.00  0.00           C  
HETATM    5  C   UNK A   0      -8.491   1.392  -0.016  1.00  0.00           C  
HETATM    6  C   UNK A   0      -9.428   1.873  -0.907  1.00  0.00           C  
HETATM    7  C   UNK A   0      -6.566  -0.097   0.528  1.00  0.00           C  
HETATM    8  C   UNK A   0      -6.971  -0.658   1.737  1.00  0.00           C  
HETATM    9  C   UNK A   0      -6.030  -1.143   2.624  1.00  0.00           C  
HETATM   10  C   UNK A   0      -4.684  -1.073   2.315  1.00  0.00           C  
HETATM   11  C   UNK A   0      -4.272  -0.515   1.112  1.00  0.00           C  
HETATM   12  C   UNK A   0      -5.210  -0.032   0.214  1.00  0.00           C  
HETATM   13  C   UNK A   0      -4.765   0.575  -1.092  1.00  0.00           C  
HETATM   14  C   UNK A   0      -2.108   0.593   1.111  1.00  0.00           C  
HETATM   15  C   UNK A   0      -0.743   0.297   0.625  1.00  0.00           C  
HETATM   16  C   UNK A   0      -0.819  -0.974   0.016  1.00  0.00           C  
HETATM   17  C   UNK A   0      -2.223  -1.405   0.153  1.00  0.00           C  
HETATM   18  C   UNK A   0       0.462   0.974   0.659  1.00  0.00           C  
HETATM   19  C   UNK A   0       1.595   0.395   0.091  1.00  0.00           C  
HETATM   20  C   UNK A   0       1.518  -0.855  -0.508  1.00  0.00           C  
HETATM   21  C   UNK A   0       0.315  -1.538  -0.551  1.00  0.00           C  
HETATM   22  C   UNK A   0       2.749  -1.468  -1.123  1.00  0.00           C  
ATOM     23  CA  THR A   1       4.787  -2.680  -0.632  1.00  0.00           C  
ATOM     24  CB  THR A   1       5.878  -2.731   0.439  1.00  0.00           C  
ATOM     25  C   THR A   1       4.476  -4.079  -1.100  1.00  0.00           C  
ATOM     26  CG2 THR A   1       7.177  -3.249  -0.180  1.00  0.00           C  
HETATM   27  C   UNK A   0       2.790   2.339   0.754  1.00  0.00           C  
HETATM   28  C   UNK A   0       4.180   2.917   0.693  1.00  0.00           C  
HETATM   29  C   UNK A   0       4.555   3.698  -0.380  1.00  0.00           C  
HETATM   30  C   UNK A   0       5.843   4.233  -0.435  1.00  0.00           C  
HETATM   31  C   UNK A   0       6.744   3.974   0.600  1.00  0.00           C  
HETATM   32  C   UNK A   0       6.356   3.191   1.668  1.00  0.00           C  
HETATM   33  C   UNK A   0       5.076   2.668   1.718  1.00  0.00           C  
HETATM   34  C   UNK A   0       6.239   5.045  -1.546  1.00  0.00           C  
HETATM   35  N   UNK A   0      -2.906  -0.446   0.803  1.00  0.00           N  
ATOM     36  N   THR A   1       3.575  -2.071  -0.068  1.00  0.00           N  
HETATM   37  N   UNK A   0       6.553   5.688  -2.428  1.00  0.00           N  
HETATM   38  O   UNK A   0      -2.685  -2.454  -0.250  1.00  0.00           O  
HETATM   39  O   UNK A   0      -2.450   1.601   1.695  1.00  0.00           O  
ATOM     40  OXT THR A   1       5.440  -4.831  -1.654  1.00  0.00           O  
ATOM     41  O   THR A   1       3.359  -4.523  -0.976  1.00  0.00           O  
ATOM     42  OG1 THR A   1       5.470  -3.607   1.492  1.00  0.00           O  
HETATM   43  O   UNK A   0       2.780   1.057   0.123  1.00  0.00           O  
HETATM   44  H   UNK A   0     -10.206   1.766  -2.895  1.00  0.00           H  
HETATM   45  H   UNK A   0      -8.594   0.057  -3.628  1.00  0.00           H  
HETATM   46  H   UNK A   0      -6.910  -0.806  -2.056  1.00  0.00           H  
HETATM   47  H   UNK A   0      -8.464   1.768   0.996  1.00  0.00           H  
HETATM   48  H   UNK A   0     -10.138   2.624  -0.590  1.00  0.00           H  
HETATM   49  H   UNK A   0      -8.021  -0.714   1.981  1.00  0.00           H  
HETATM   50  H   UNK A   0      -6.346  -1.577   3.560  1.00  0.00           H  
HETATM   51  H   UNK A   0      -3.952  -1.454   3.012  1.00  0.00           H  
HETATM   52  H   UNK A   0      -4.796  -0.184  -1.874  1.00  0.00           H  
HETATM   53  H   UNK A   0      -5.431   1.396  -1.356  1.00  0.00           H  
HETATM   54  H   UNK A   0      -3.747   0.950  -0.990  1.00  0.00           H  
HETATM   55  H   UNK A   0       0.525   1.947   1.124  1.00  0.00           H  
HETATM   56  H   UNK A   0       0.261  -2.510  -1.018  1.00  0.00           H  
HETATM   57  H   UNK A   0       2.454  -2.236  -1.838  1.00  0.00           H  
HETATM   58  H   UNK A   0       3.322  -0.695  -1.635  1.00  0.00           H  
ATOM     59  HA  THR A   1       5.134  -2.084  -1.476  1.00  0.00           H  
ATOM     60  HB  THR A   1       6.040  -1.731   0.840  1.00  0.00           H  
ATOM     61 HG21 THR A   1       7.488  -2.581  -0.984  1.00  0.00           H  
ATOM     62 HG22 THR A   1       7.955  -3.286   0.583  1.00  0.00           H  
ATOM     63 HG23 THR A   1       7.015  -4.249  -0.582  1.00  0.00           H  
HETATM   64  H   UNK A   0       2.485   2.234   1.795  1.00  0.00           H  
HETATM   65  H   UNK A   0       2.097   3.003   0.237  1.00  0.00           H  
HETATM   66  H   UNK A   0       3.853   3.894  -1.178  1.00  0.00           H  
HETATM   67  H   UNK A   0       7.742   4.385   0.564  1.00  0.00           H  
HETATM   68  H   UNK A   0       7.052   2.989   2.469  1.00  0.00           H  
HETATM   69  H   UNK A   0       4.778   2.056   2.556  1.00  0.00           H  
ATOM     70  H   THR A   1       3.807  -1.393   0.641  1.00  0.00           H  
ATOM     71  HXT THR A   1       5.193  -5.721  -1.938  1.00  0.00           H  
ATOM     72  HG1 THR A   1       5.308  -4.516   1.207  1.00  0.00           H  
CONECT    1    6    6    2   44                                       
CONECT    2    3    3    1   45                                       
CONECT    3    4    2    2   46                                       
CONECT    4    7    5    5    3                                       
CONECT    5    4    4    6   47                                       
CONECT    6    5    1    1   48                                       
CONECT    7    8    8   12    4                                       
CONECT    8    9    7    7   49                                       
CONECT    9   10   10    8   50                                       
CONECT   10    9    9   11   51                                       
CONECT   11   10   35   12   12                                       
CONECT   12   11   11    7   13                                       
CONECT   13   12   52   53   54                                       
CONECT   14   15   35   39   39                                       
CONECT   15   16   16   18   14                                       
CONECT   16   21   17   15   15                                       
CONECT   17   38   38   16   35                                       
CONECT   18   19   19   15   55                                       
CONECT   19   20   43   18   18                                       
CONECT   20   22   21   21   19                                       
CONECT   21   20   20   16   56                                       
CONECT   22   20   36   57   58                                       
CONECT   23   25   36   24   59                                       
CONECT   24   23   26   42   60                                       
CONECT   25   41   41   23   40                                       
CONECT   26   24   61   62   63                                       
CONECT   27   43   28   64   65                                       
CONECT   28   33   27   29   29                                       
CONECT   29   28   28   30   66                                       
CONECT   30   31   31   29   34                                       
CONECT   31   32   30   30   67                                       
CONECT   32   33   33   31   68                                       
CONECT   33   32   32   28   69                                       
CONECT   34   30   37   37   37                                       
CONECT   35   17   14   11                                            
CONECT   36   22   23   70                                            
CONECT   37   34   34   34                                            
CONECT   38   17   17                                                 
CONECT   39   14   14                                                 
CONECT   40   25   71                                                 
CONECT   41   25   25                                                 
CONECT   42   24   72                                                 
CONECT   43   19   27                                                 
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   18                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   29                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   36                                                      
CONECT   71   40                                                      
CONECT   72   42                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
