COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   1      -5.812   2.722   1.865  1.00  0.00           N  
HETATM    2  C   UNK A   1      -5.495   3.029   0.464  1.00  0.00           C  
HETATM    3  C   UNK A   1      -6.761   3.381  -0.273  1.00  0.00           C  
HETATM    4  O   UNK A   1      -7.832   3.041   0.170  1.00  0.00           O  
HETATM    5  O   UNK A   1      -6.699   4.071  -1.423  1.00  0.00           O  
HETATM    6  C   UNK A   1      -4.846   1.807  -0.191  1.00  0.00           C  
HETATM    7  C   UNK A   1      -3.499   1.525   0.477  1.00  0.00           C  
HETATM    8  C   UNK A   1      -2.860   0.322  -0.168  1.00  0.00           C  
HETATM    9  O   UNK A   1      -3.427  -0.253  -1.073  1.00  0.00           O  
HETATM   10  N   UNK A   1      -1.659  -0.114   0.261  1.00  0.00           N  
HETATM   11  C   UNK A   1      -1.039  -1.284  -0.365  1.00  0.00           C  
HETATM   12  C   UNK A   1      -1.565  -2.539   0.282  1.00  0.00           C  
HETATM   13  O   UNK A   1      -2.378  -2.464   1.178  1.00  0.00           O  
HETATM   14  C   UNK A   1       0.479  -1.214  -0.184  1.00  0.00           C  
HETATM   15  S   UNK A   1       1.112   0.297  -0.963  1.00  0.00           S  
ATOM     16  N   GLY A   2      -1.131  -3.745  -0.136  1.00  0.00           N  
ATOM     17  CA  GLY A   2      -1.642  -4.965   0.493  1.00  0.00           C  
ATOM     18  C   GLY A   2      -1.004  -6.168  -0.152  1.00  0.00           C  
ATOM     19  O   GLY A   2      -0.203  -6.021  -1.045  1.00  0.00           O  
ATOM     20  OXT GLY A   2      -1.324  -7.403   0.266  1.00  0.00           O  
HETATM   21  C   UNK A   1       2.881   0.120  -0.603  1.00  0.00           C  
HETATM   22  C   UNK A   1       3.086   0.150   0.882  1.00  0.00           C  
HETATM   23  N   UNK A   1       2.804  -1.077   1.661  1.00  0.00           N1+
HETATM   24  O   UNK A   1       2.414  -2.082   1.093  1.00  0.00           O  
HETATM   25  O   UNK A   1       2.961  -1.082   2.868  1.00  0.00           O1-
HETATM   26  C   UNK A   1       3.499   1.205   1.515  1.00  0.00           C  
HETATM   27  C   UNK A   1       3.813   2.497   0.822  1.00  0.00           C  
HETATM   28  N   UNK A   1       5.016   3.083   1.420  1.00  0.00           N1+
HETATM   29  O   UNK A   1       6.074   2.482   1.371  1.00  0.00           O  
HETATM   30  O   UNK A   1       4.956   4.170   1.967  1.00  0.00           O1-
HETATM   31  C   UNK A   1       4.047   2.284  -0.643  1.00  0.00           C  
HETATM   32  C   UNK A   1       3.633   1.228  -1.276  1.00  0.00           C  
HETATM   33  N   UNK A   1       3.917   1.114  -2.724  1.00  0.00           N1+
HETATM   34  O   UNK A   1       3.541   0.135  -3.343  1.00  0.00           O  
HETATM   35  O   UNK A   1       4.526   2.000  -3.297  1.00  0.00           O1-
HETATM   36  H   UNK A   1      -6.328   3.512   2.224  1.00  0.00           H  
HETATM   37  H   UNK A   1      -6.450   1.940   1.853  1.00  0.00           H  
HETATM   38  H   UNK A   1      -4.805   3.872   0.423  1.00  0.00           H  
HETATM   39  H   UNK A   1      -7.512   4.297  -1.895  1.00  0.00           H  
HETATM   40  H   UNK A   1      -5.499   0.942  -0.072  1.00  0.00           H  
HETATM   41  H   UNK A   1      -4.691   2.003  -1.252  1.00  0.00           H  
HETATM   42  H   UNK A   1      -2.846   2.391   0.359  1.00  0.00           H  
HETATM   43  H   UNK A   1      -3.654   1.330   1.538  1.00  0.00           H  
HETATM   44  H   UNK A   1      -1.206   0.346   0.985  1.00  0.00           H  
HETATM   45  H   UNK A   1      -1.277  -1.296  -1.429  1.00  0.00           H  
HETATM   46  H   UNK A   1       0.718  -1.202   0.879  1.00  0.00           H  
HETATM   47  H   UNK A   1       0.941  -2.084  -0.651  1.00  0.00           H  
ATOM     48  H   GLY A   2      -0.480  -3.805  -0.853  1.00  0.00           H  
ATOM     49  HA1 GLY A   2      -1.404  -4.953   1.556  1.00  0.00           H  
ATOM     50  HA2 GLY A   2      -2.724  -5.015   0.364  1.00  0.00           H  
ATOM     51  HXT GLY A   2      -0.914  -8.175  -0.148  1.00  0.00           H  
HETATM   52  H   UNK A   1       3.231  -0.837  -0.991  1.00  0.00           H  
HETATM   53  H   UNK A   1       3.623   1.149   2.586  1.00  0.00           H  
HETATM   54  H   UNK A   1       2.978   3.185   0.954  1.00  0.00           H  
HETATM   55  H   UNK A   1       4.583   3.041  -1.196  1.00  0.00           H  
CONECT    1    2   36   37                                            
CONECT    2    1    3    6   38                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3   39                                                 
CONECT    6    2    7   40   41                                       
CONECT    7    6    8   42   43                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   44                                            
CONECT   11   10   12   14   45                                       
CONECT   12   11   13   13   16                                       
CONECT   13   12   12                                                 
CONECT   14   11   15   46   47                                       
CONECT   15   14   21                                                 
CONECT   16   12   17   48                                            
CONECT   17   16   18   49   50                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   51                                                 
CONECT   21   15   22   32   52                                       
CONECT   22   21   23   26   26                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23                                                      
CONECT   26   22   22   27   53                                       
CONECT   27   26   28   31   54                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28                                                      
CONECT   31   27   32   32   55                                       
CONECT   32   21   31   31   33                                       
CONECT   33   32   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
