COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -4.398  -2.743  -0.550  1.00  0.00           C  
HETATM    2  C   UNK A   0      -1.645  -0.272   0.218  1.00  0.00           C  
HETATM    3  C   UNK A   0      -3.148  -2.205  -0.302  1.00  0.00           C  
HETATM    4  C   UNK A   0      -3.010  -0.851  -0.052  1.00  0.00           C  
HETATM    5  C   UNK A   0      -7.737   2.240  -1.142  1.00  0.00           C  
HETATM    6  C   UNK A   0      -6.576   0.312  -0.306  1.00  0.00           C  
HETATM    7  C   UNK A   0      -7.655   0.028   0.528  1.00  0.00           C  
HETATM    8  C   UNK A   0      -8.769   0.843   0.513  1.00  0.00           C  
HETATM    9  C   UNK A   0      -8.808   1.949  -0.317  1.00  0.00           C  
HETATM   10  C   UNK A   0      -6.623   1.425  -1.144  1.00  0.00           C  
HETATM   11  C   UNK A   0      -3.967   1.444   0.225  1.00  0.00           C  
ATOM     12  N   ALA A   1       5.332   0.526  -0.190  1.00  0.00           N  
HETATM   13  C   UNK A   0      -5.514  -1.930  -0.554  1.00  0.00           C  
HETATM   14  C   UNK A   0      -4.119  -0.031  -0.048  1.00  0.00           C  
HETATM   15  C   UNK A   0       0.626  -0.956   0.383  1.00  0.00           C  
HETATM   16  C   UNK A   0       1.626  -1.916   0.343  1.00  0.00           C  
HETATM   17  C   UNK A   0       2.945  -1.553   0.570  1.00  0.00           C  
HETATM   18  C   UNK A   0       3.264  -0.230   0.837  1.00  0.00           C  
HETATM   19  C   UNK A   0       2.264   0.730   0.877  1.00  0.00           C  
HETATM   20  C   UNK A   0      -5.380  -0.566  -0.303  1.00  0.00           C  
HETATM   21  C   UNK A   0       0.945   0.367   0.646  1.00  0.00           C  
HETATM   22  C   UNK A   0       1.497   2.964   1.151  1.00  0.00           C  
HETATM   23  C   UNK A   0       3.525  -3.836   0.250  1.00  0.00           C  
HETATM   24  C   UNK A   0       4.697   0.165   1.084  1.00  0.00           C  
ATOM     25  CA  ALA A   1       6.734   0.917   0.012  1.00  0.00           C  
ATOM     26  C   ALA A   1       7.508   0.688  -1.260  1.00  0.00           C  
ATOM     27  CB  ALA A   1       6.800   2.398   0.390  1.00  0.00           C  
HETATM   28  O   UNK A   0      -0.667  -1.312   0.161  1.00  0.00           O  
HETATM   29  O   UNK A   0       2.577   2.027   1.135  1.00  0.00           O  
HETATM   30  O   UNK A   0       3.925  -2.493   0.530  1.00  0.00           O  
ATOM     31  O   ALA A   1       6.950   0.244  -2.235  1.00  0.00           O  
ATOM     32  OXT ALA A   1       8.818   0.976  -1.310  1.00  0.00           O  
HETATM   33  H   UNK A   0      -4.501  -3.800  -0.745  1.00  0.00           H  
HETATM   34  H   UNK A   0      -1.416   0.484  -0.533  1.00  0.00           H  
HETATM   35  H   UNK A   0      -1.633   0.183   1.208  1.00  0.00           H  
HETATM   36  H   UNK A   0      -2.278  -2.843  -0.305  1.00  0.00           H  
HETATM   37  H   UNK A   0      -7.775   3.102  -1.791  1.00  0.00           H  
HETATM   38  H   UNK A   0      -7.624  -0.833   1.178  1.00  0.00           H  
HETATM   39  H   UNK A   0      -9.606   0.624   1.159  1.00  0.00           H  
HETATM   40  H   UNK A   0      -9.679   2.589  -0.319  1.00  0.00           H  
HETATM   41  H   UNK A   0      -5.789   1.650  -1.792  1.00  0.00           H  
HETATM   42  H   UNK A   0      -3.857   1.978  -0.719  1.00  0.00           H  
HETATM   43  H   UNK A   0      -4.849   1.809   0.749  1.00  0.00           H  
HETATM   44  H   UNK A   0      -3.083   1.610   0.841  1.00  0.00           H  
ATOM     45  H   ALA A   1       5.260  -0.228  -0.857  1.00  0.00           H  
HETATM   46  H   UNK A   0      -6.489  -2.351  -0.753  1.00  0.00           H  
HETATM   47  H   UNK A   0       1.378  -2.946   0.134  1.00  0.00           H  
HETATM   48  H   UNK A   0       0.166   1.115   0.677  1.00  0.00           H  
HETATM   49  H   UNK A   0       1.884   3.959   1.368  1.00  0.00           H  
HETATM   50  H   UNK A   0       1.006   2.968   0.178  1.00  0.00           H  
HETATM   51  H   UNK A   0       0.780   2.677   1.920  1.00  0.00           H  
HETATM   52  H   UNK A   0       2.825  -4.174   1.014  1.00  0.00           H  
HETATM   53  H   UNK A   0       3.043  -3.875  -0.727  1.00  0.00           H  
HETATM   54  H   UNK A   0       4.402  -4.484   0.248  1.00  0.00           H  
HETATM   55  H   UNK A   0       5.232  -0.672   1.532  1.00  0.00           H  
HETATM   56  H   UNK A   0       4.727   1.019   1.760  1.00  0.00           H  
ATOM     57  HA  ALA A   1       7.166   0.318   0.814  1.00  0.00           H  
ATOM     58  HB1 ALA A   1       6.240   2.564   1.310  1.00  0.00           H  
ATOM     59  HB2 ALA A   1       7.840   2.688   0.540  1.00  0.00           H  
ATOM     60  HB3 ALA A   1       6.368   2.997  -0.412  1.00  0.00           H  
ATOM     61  HXT ALA A   1       9.272   0.812  -2.147  1.00  0.00           H  
CONECT    1    3    3   13   33                                       
CONECT    2   28    4   34   35                                       
CONECT    3    4    1    1   36                                       
CONECT    4    2   14   14    3                                       
CONECT    5    9   10   10   37                                       
CONECT    6    7    7   10   20                                       
CONECT    7    8    6    6   38                                       
CONECT    8    9    9    7   39                                       
CONECT    9    8    8    5   40                                       
CONECT   10    5    5    6   41                                       
CONECT   11   14   42   43   44                                       
CONECT   12   24   25   45                                            
CONECT   13   20   20    1   46                                       
CONECT   14   11    4    4   20                                       
CONECT   15   21   28   16   16                                       
CONECT   16   15   15   17   47                                       
CONECT   17   18   18   16   30                                       
CONECT   18   19   24   17   17                                       
CONECT   19   29   21   21   18                                       
CONECT   20   14    6   13   13                                       
CONECT   21   19   19   15   48                                       
CONECT   22   29   49   50   51                                       
CONECT   23   30   52   53   54                                       
CONECT   24   12   18   55   56                                       
CONECT   25   12   27   26   57                                       
CONECT   26   25   31   31   32                                       
CONECT   27   25   58   59   60                                       
CONECT   28    2   15                                                 
CONECT   29   22   19                                                 
CONECT   30   17   23                                                 
CONECT   31   26   26                                                 
CONECT   32   26   61                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   16                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
