COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -0.049   3.613   0.178  1.00  0.00           C  
HETATM    2  C   UNK A   0      -0.444   2.139   0.064  1.00  0.00           C  
HETATM    3  O   UNK A   0       0.573  -0.333   0.470  1.00  0.00           O  
HETATM    4  C   UNK A   0       2.390   1.422  -0.495  1.00  0.00           C  
HETATM    5  C   UNK A   0       3.524   0.457  -0.143  1.00  0.00           C  
HETATM    6  C   UNK A   0       3.199  -0.934  -0.693  1.00  0.00           C  
HETATM    7  C   UNK A   0       4.811   0.950  -0.752  1.00  0.00           C  
HETATM    8  C   UNK A   0       4.260  -1.909  -0.251  1.00  0.00           C  
HETATM    9  C   UNK A   0       4.170  -2.512   0.990  1.00  0.00           C  
HETATM   10  C   UNK A   0       5.143  -3.406   1.396  1.00  0.00           C  
HETATM   11  C   UNK A   0       6.205  -3.698   0.561  1.00  0.00           C  
HETATM   12  C   UNK A   0       6.294  -3.095  -0.680  1.00  0.00           C  
HETATM   13  C   UNK A   0       5.319  -2.205  -1.088  1.00  0.00           C  
HETATM   14  C   UNK A   0      -4.846   0.035   0.592  1.00  0.00           C  
HETATM   15  N   UNK A   0      -5.631  -1.075   2.629  1.00  0.00           N  
HETATM   16  C   UNK A   0      -2.634   1.148   0.465  1.00  0.00           C  
HETATM   17  C   UNK A   0      -3.820   0.875   1.354  1.00  0.00           C  
ATOM     18  CA  ALA A   1       7.243   1.099  -0.773  1.00  0.00           C  
HETATM   19  N   UNK A   0      -8.001  -2.535  -2.652  1.00  0.00           N  
HETATM   20  C   UNK A   0      -8.438  -1.799  -1.904  1.00  0.00           C  
HETATM   21  C   UNK A   0      -9.004  -0.846  -0.936  1.00  0.00           C  
HETATM   22  C   UNK A   0      -9.683   0.321  -1.684  1.00  0.00           C  
HETATM   23  C   UNK A   0      -9.322   1.551  -0.809  1.00  0.00           C  
HETATM   24  C   UNK A   0      -7.893   1.186  -0.334  1.00  0.00           C  
HETATM   25  N   UNK A   0      -7.930  -0.271  -0.113  1.00  0.00           N  
HETATM   26  C   UNK A   0      -7.114  -0.962   0.707  1.00  0.00           C  
HETATM   27  O   UNK A   0      -7.235  -2.165   0.811  1.00  0.00           O  
HETATM   28  C   UNK A   0      -6.050  -0.241   1.495  1.00  0.00           C  
HETATM   29  O   UNK A   0      -2.612   0.713  -0.666  1.00  0.00           O  
HETATM   30  N   UNK A   0      -1.597   1.875   0.928  1.00  0.00           N  
HETATM   31  P   UNK A   0       0.956   1.092   0.581  1.00  0.00           P  
HETATM   32  O   UNK A   0       1.341   1.428   2.107  1.00  0.00           O  
ATOM     33  N   ALA A   1       5.984   0.717  -0.129  1.00  0.00           N  
ATOM     34  C   ALA A   1       8.344   0.184  -0.304  1.00  0.00           C  
ATOM     35  OXT ALA A   1       9.467   0.057  -1.030  1.00  0.00           O  
ATOM     36  O   ALA A   1       8.218  -0.435   0.726  1.00  0.00           O  
ATOM     37  CB  ALA A   1       7.588   2.543  -0.403  1.00  0.00           C  
HETATM   38  O   UNK A   0       4.792   1.556  -1.802  1.00  0.00           O  
HETATM   39  H   UNK A   0       0.212   3.840   1.212  1.00  0.00           H  
HETATM   40  H   UNK A   0       0.809   3.810  -0.465  1.00  0.00           H  
HETATM   41  H   UNK A   0      -0.886   4.239  -0.131  1.00  0.00           H  
HETATM   42  H   UNK A   0      -0.706   1.913  -0.970  1.00  0.00           H  
HETATM   43  H   UNK A   0       2.727   2.448  -0.347  1.00  0.00           H  
HETATM   44  H   UNK A   0       2.103   1.280  -1.537  1.00  0.00           H  
HETATM   45  H   UNK A   0       3.632   0.403   0.941  1.00  0.00           H  
HETATM   46  H   UNK A   0       2.229  -1.256  -0.315  1.00  0.00           H  
HETATM   47  H   UNK A   0       3.172  -0.896  -1.782  1.00  0.00           H  
HETATM   48  H   UNK A   0       3.341  -2.283   1.643  1.00  0.00           H  
HETATM   49  H   UNK A   0       5.073  -3.877   2.366  1.00  0.00           H  
HETATM   50  H   UNK A   0       6.965  -4.397   0.878  1.00  0.00           H  
HETATM   51  H   UNK A   0       7.124  -3.323  -1.333  1.00  0.00           H  
HETATM   52  H   UNK A   0       5.386  -1.738  -2.059  1.00  0.00           H  
HETATM   53  H   UNK A   0      -5.174   0.578  -0.294  1.00  0.00           H  
HETATM   54  H   UNK A   0      -4.392  -0.909   0.293  1.00  0.00           H  
HETATM   55  H   UNK A   0      -6.393  -1.218   3.274  1.00  0.00           H  
HETATM   56  H   UNK A   0      -5.256  -1.956   2.311  1.00  0.00           H  
HETATM   57  H   UNK A   0      -4.274   1.820   1.654  1.00  0.00           H  
HETATM   58  H   UNK A   0      -3.492   0.333   2.241  1.00  0.00           H  
ATOM     59  HA  ALA A   1       7.138   1.016  -1.855  1.00  0.00           H  
HETATM   60  H   UNK A   0      -9.729  -1.352  -0.298  1.00  0.00           H  
HETATM   61  H   UNK A   0      -9.271   0.427  -2.687  1.00  0.00           H  
HETATM   62  H   UNK A   0     -10.762   0.177  -1.725  1.00  0.00           H  
HETATM   63  H   UNK A   0      -9.314   2.464  -1.403  1.00  0.00           H  
HETATM   64  H   UNK A   0     -10.003   1.642   0.037  1.00  0.00           H  
HETATM   65  H   UNK A   0      -7.162   1.435  -1.103  1.00  0.00           H  
HETATM   66  H   UNK A   0      -7.659   1.704   0.596  1.00  0.00           H  
HETATM   67  H   UNK A   0      -6.450   0.702   1.866  1.00  0.00           H  
HETATM   68  H   UNK A   0      -1.615   2.223   1.833  1.00  0.00           H  
HETATM   69  H   UNK A   0       1.603   2.347   2.254  1.00  0.00           H  
ATOM     70  H   ALA A   1       5.994   0.298   0.745  1.00  0.00           H  
ATOM     71  HXT ALA A   1      10.145  -0.541  -0.688  1.00  0.00           H  
ATOM     72  HB1 ALA A   1       8.524   2.827  -0.882  1.00  0.00           H  
ATOM     73  HB2 ALA A   1       6.791   3.205  -0.743  1.00  0.00           H  
ATOM     74  HB3 ALA A   1       7.693   2.626   0.678  1.00  0.00           H  
CONECT    1    2   39   40   41                                       
CONECT    2   30   31    1   42                                       
CONECT    3   31   31                                                 
CONECT    4   31    5   43   44                                       
CONECT    5    4    6    7   45                                       
CONECT    6    5    8   46   47                                       
CONECT    7    5   38   38   33                                       
CONECT    8    6   13   13    9                                       
CONECT    9    8   10   10   48                                       
CONECT   10    9    9   11   49                                       
CONECT   11   12   12   10   50                                       
CONECT   12   13   11   11   51                                       
CONECT   13    8    8   12   52                                       
CONECT   14   28   17   53   54                                       
CONECT   15   28   55   56                                            
CONECT   16   17   29   29   30                                       
CONECT   17   14   16   57   58                                       
CONECT   18   33   34   37   59                                       
CONECT   19   20   20   20                                            
CONECT   20   21   19   19   19                                       
CONECT   21   22   20   25   60                                       
CONECT   22   23   21   61   62                                       
CONECT   23   22   24   63   64                                       
CONECT   24   23   25   65   66                                       
CONECT   25   24   21   26                                            
CONECT   26   25   28   27   27                                       
CONECT   27   26   26                                                 
CONECT   28   26   15   14   67                                       
CONECT   29   16   16                                                 
CONECT   30   16    2   68                                            
CONECT   31    3    3    2   32                                       
CONECT   31    4                                                      
CONECT   32   31   69                                                 
CONECT   33    7   18   70                                            
CONECT   34   36   36   18   35                                       
CONECT   35   34   71                                                 
CONECT   36   34   34                                                 
CONECT   37   18   72   73   74                                       
CONECT   38    7    7                                                 
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   28                                                      
CONECT   68   30                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   35                                                      
CONECT   72   37                                                      
CONECT   73   37                                                      
CONECT   74   37                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
