COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1       8.555  -1.209  -1.084  1.00  0.00           C  
HETATM    2  O   UNK A   1       8.569  -2.053  -2.128  1.00  0.00           O  
HETATM    3  O   UNK A   1       9.422  -0.375  -0.970  1.00  0.00           O  
HETATM    4  N   UNK A   1       7.894  -0.646   1.185  1.00  0.00           N  
HETATM    5  C   UNK A   1       7.458  -1.301  -0.055  1.00  0.00           C  
HETATM    6  C   UNK A   1       6.202  -0.607  -0.585  1.00  0.00           C  
HETATM    7  C   UNK A   1       0.227  -0.174   0.676  1.00  0.00           C  
HETATM    8  S   UNK A   1       0.199  -1.922   0.194  1.00  0.00           S  
HETATM    9  C   UNK A   1       5.053  -0.808   0.405  1.00  0.00           C  
HETATM   10  C   UNK A   1       3.816  -0.123  -0.117  1.00  0.00           C  
HETATM   11  O   UNK A   1       3.850   0.467  -1.176  1.00  0.00           O  
HETATM   12  N   UNK A   1       2.671  -0.167   0.593  1.00  0.00           N  
HETATM   13  C   UNK A   1       1.468   0.498   0.086  1.00  0.00           C  
HETATM   14  C   UNK A   1       1.491   1.951   0.486  1.00  0.00           C  
HETATM   15  O   UNK A   1       2.421   2.387   1.131  1.00  0.00           O  
ATOM     16  N   GLY A   2       0.479   2.765   0.127  1.00  0.00           N  
ATOM     17  CA  GLY A   2       0.501   4.177   0.516  1.00  0.00           C  
ATOM     18  C   GLY A   2      -0.736   4.861  -0.006  1.00  0.00           C  
ATOM     19  O   GLY A   2      -0.931   6.168   0.232  1.00  0.00           O  
ATOM     20  OXT GLY A   2      -1.553   4.234  -0.638  1.00  0.00           O  
HETATM   21  C   UNK A   1      -1.271  -2.476   1.102  1.00  0.00           C  
HETATM   22  O   UNK A   1      -1.104  -2.198   2.493  1.00  0.00           O  
HETATM   23  C   UNK A   1      -4.812  -1.906   0.471  1.00  0.00           C  
HETATM   24  C   UNK A   1      -5.291  -2.337  -0.752  1.00  0.00           C  
HETATM   25  C   UNK A   1      -5.480  -0.915   1.165  1.00  0.00           C  
HETATM   26  C   UNK A   1      -6.435  -1.772  -1.284  1.00  0.00           C  
HETATM   27  C   UNK A   1      -6.622  -0.348   0.632  1.00  0.00           C  
HETATM   28  C   UNK A   1      -7.101  -0.777  -0.592  1.00  0.00           C  
HETATM   29  O   UNK A   1      -2.421  -1.784   0.613  1.00  0.00           O  
HETATM   30  C   UNK A   1      -3.564  -2.522   1.051  1.00  0.00           C  
HETATM   31  N   UNK A   1      -8.325  -0.172  -1.161  1.00  0.00           N1+
HETATM   32  O   UNK A   1      -8.747  -0.550  -2.240  1.00  0.00           O1-
HETATM   33  O   UNK A   1      -8.912   0.704  -0.552  1.00  0.00           O  
HETATM   34  H   UNK A   1       9.273  -1.993  -2.788  1.00  0.00           H  
HETATM   35  H   UNK A   1       8.088   0.316   0.952  1.00  0.00           H  
HETATM   36  H   UNK A   1       7.098  -0.640   1.805  1.00  0.00           H  
HETATM   37  H   UNK A   1       7.236  -2.349   0.146  1.00  0.00           H  
HETATM   38  H   UNK A   1       6.399   0.459  -0.702  1.00  0.00           H  
HETATM   39  H   UNK A   1       5.930  -1.034  -1.550  1.00  0.00           H  
HETATM   40  H   UNK A   1       0.253  -0.097   1.763  1.00  0.00           H  
HETATM   41  H   UNK A   1      -0.668   0.321   0.298  1.00  0.00           H  
HETATM   42  H   UNK A   1       4.856  -1.873   0.522  1.00  0.00           H  
HETATM   43  H   UNK A   1       5.325  -0.380   1.370  1.00  0.00           H  
HETATM   44  H   UNK A   1       2.643  -0.639   1.440  1.00  0.00           H  
HETATM   45  H   UNK A   1       1.441   0.421  -1.001  1.00  0.00           H  
ATOM     46  H   GLY A   2      -0.265   2.416  -0.389  1.00  0.00           H  
ATOM     47  HA1 GLY A   2       0.528   4.254   1.603  1.00  0.00           H  
ATOM     48  HA2 GLY A   2       1.386   4.656   0.096  1.00  0.00           H  
ATOM     49  HXT GLY A   2       0.000   0.000   0.000  1.00  0.00           H  
HETATM   50  H   UNK A   1      -1.404  -3.548   0.959  1.00  0.00           H  
HETATM   51  H   UNK A   1      -1.098  -1.236   2.588  1.00  0.00           H  
HETATM   52  H   UNK A   1      -4.771  -3.114  -1.293  1.00  0.00           H  
HETATM   53  H   UNK A   1      -5.106  -0.580   2.121  1.00  0.00           H  
HETATM   54  H   UNK A   1      -6.809  -2.108  -2.240  1.00  0.00           H  
HETATM   55  H   UNK A   1      -7.142   0.430   1.172  1.00  0.00           H  
HETATM   56  H   UNK A   1      -3.480  -3.555   0.715  1.00  0.00           H  
HETATM   57  H   UNK A   1      -3.618  -2.496   2.139  1.00  0.00           H  
CONECT    1    2    3    3    5                                       
CONECT    2    1   34                                                 
CONECT    3    1    1                                                 
CONECT    4    5   35   36                                            
CONECT    5    1    4    6   37                                       
CONECT    6    5    9   38   39                                       
CONECT    7    8   13   40   41                                       
CONECT    8    7   21                                                 
CONECT    9    6   10   42   43                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   44                                            
CONECT   13    7   12   14   45                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   46                                            
CONECT   17   16   18   47   48                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   49                                                 
CONECT   21    8   22   29   50                                       
CONECT   22   21   51                                                 
CONECT   23   24   24   25   30                                       
CONECT   24   23   23   26   52                                       
CONECT   25   23   27   27   53                                       
CONECT   26   24   28   28   54                                       
CONECT   27   25   25   28   55                                       
CONECT   28   26   26   27   31                                       
CONECT   29   21   30                                                 
CONECT   30   23   29   56   57                                       
CONECT   31   28   32   33   33                                       
CONECT   32   31                                                      
CONECT   33   31   31                                                 
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
