COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   1      -6.879   2.486   2.409  1.00  0.00           N  
HETATM    2  C   UNK A   1      -5.600   3.091   2.016  1.00  0.00           C  
HETATM    3  C   UNK A   1      -4.829   2.118   1.122  1.00  0.00           C  
HETATM    4  C   UNK A   1      -4.479   0.860   1.921  1.00  0.00           C  
HETATM    5  C   UNK A   1      -3.620  -0.047   1.079  1.00  0.00           C  
HETATM    6  O   UNK A   1      -3.390   0.237  -0.077  1.00  0.00           O  
HETATM    7  N   UNK A   1      -3.107  -1.174   1.611  1.00  0.00           N  
HETATM    8  C   UNK A   1      -2.188  -2.002   0.826  1.00  0.00           C  
HETATM    9  C   UNK A   1      -1.344  -2.862   1.769  1.00  0.00           C  
HETATM   10  S   UNK A   1      -0.342  -1.786   2.832  1.00  0.00           S  
HETATM   11  S   UNK A   1       2.728   0.189   2.598  1.00  0.00           S  
HETATM   12  C   UNK A   1       3.987   0.593   1.355  1.00  0.00           C  
HETATM   13  C   UNK A   1       3.416   1.607   0.362  1.00  0.00           C  
HETATM   14  N   UNK A   1       2.241   1.034  -0.300  1.00  0.00           N  
HETATM   15  C   UNK A   1       1.293   1.844  -0.810  1.00  0.00           C  
HETATM   16  O   UNK A   1       1.411   3.048  -0.720  1.00  0.00           O  
HETATM   17  C   UNK A   1       0.085   1.255  -1.491  1.00  0.00           C  
HETATM   18  C   UNK A   1      -0.829   2.382  -1.975  1.00  0.00           C  
HETATM   19  C   UNK A   1      -2.056   1.784  -2.667  1.00  0.00           C  
HETATM   20  N   UNK A   1      -1.635   1.076  -3.883  1.00  0.00           N  
HETATM   21  C   UNK A   1      -3.014   2.888  -3.034  1.00  0.00           C  
HETATM   22  O   UNK A   1      -3.832   3.403  -2.103  1.00  0.00           O  
HETATM   23  O   UNK A   1      -3.045   3.309  -4.166  1.00  0.00           O  
HETATM   24  C   UNK A   1       4.461   1.943  -0.670  1.00  0.00           C  
HETATM   25  O   UNK A   1       4.246   1.724  -1.844  1.00  0.00           O  
ATOM     26  N   GLY A   2       5.635   2.485  -0.289  1.00  0.00           N  
ATOM     27  CA  GLY A   2       6.651   2.811  -1.293  1.00  0.00           C  
ATOM     28  C   GLY A   2       7.859   3.401  -0.611  1.00  0.00           C  
ATOM     29  O   GLY A   2       7.870   3.535   0.590  1.00  0.00           O  
ATOM     30  OXT GLY A   2       8.922   3.777  -1.338  1.00  0.00           O  
HETATM   31  C   UNK A   1       2.309  -2.755   0.836  1.00  0.00           C  
HETATM   32  C   UNK A   1       1.987  -3.322  -0.383  1.00  0.00           C  
HETATM   33  C   UNK A   1       2.671  -4.438  -0.829  1.00  0.00           C  
HETATM   34  C   UNK A   1       3.676  -4.987  -0.055  1.00  0.00           C  
HETATM   35  C   UNK A   1       3.999  -4.419   1.163  1.00  0.00           C  
HETATM   36  C   UNK A   1       3.318  -3.300   1.607  1.00  0.00           C  
HETATM   37  C   UNK A   1      -2.979  -2.896  -0.095  1.00  0.00           C  
HETATM   38  O   UNK A   1      -4.190  -2.846  -0.095  1.00  0.00           O  
ATOM     39  N   GLY A   2      -2.339  -3.750  -0.918  1.00  0.00           N  
ATOM     40  CA  GLY A   2      -3.108  -4.619  -1.813  1.00  0.00           C  
ATOM     41  C   GLY A   2      -2.162  -5.471  -2.620  1.00  0.00           C  
ATOM     42  OXT GLY A   2      -2.646  -6.349  -3.513  1.00  0.00           O  
ATOM     43  O   GLY A   2      -0.969  -5.363  -2.464  1.00  0.00           O  
HETATM   44  C   UNK A   1      -5.860   4.369   1.259  1.00  0.00           C  
HETATM   45  O   UNK A   1      -4.892   5.291   1.147  1.00  0.00           O  
HETATM   46  O   UNK A   1      -6.941   4.562   0.754  1.00  0.00           O  
HETATM   47 AS   UNK A   1       1.324  -1.149   1.477  1.00  0.00          As  
HETATM   48  H   UNK A   1      -2.548   1.085  -1.992  1.00  0.00           H  
ATOM     49  H   GLY A   2      -1.370  -3.790  -0.917  1.00  0.00           H  
HETATM   50  H   UNK A   1      -7.368   3.071   3.070  1.00  0.00           H  
HETATM   51  H   UNK A   1      -2.418   0.617  -4.324  1.00  0.00           H  
ATOM     52  HA1 GLY A   2      -3.762  -5.261  -1.223  1.00  0.00           H  
HETATM   53  H   UNK A   1      -7.453   2.296   1.602  1.00  0.00           H  
HETATM   54  H   UNK A   1      -1.175   1.703  -4.526  1.00  0.00           H  
ATOM     55  HA2 GLY A   2      -3.709  -4.007  -2.485  1.00  0.00           H  
HETATM   56  H   UNK A   1      -5.012   3.310   2.907  1.00  0.00           H  
HETATM   57  H   UNK A   1      -5.445   1.844   0.266  1.00  0.00           H  
HETATM   58  H   UNK A   1       4.860   1.019   1.848  1.00  0.00           H  
HETATM   59  H   UNK A   1       1.201  -2.893  -0.988  1.00  0.00           H  
HETATM   60  H   UNK A   1      -3.912   2.593   0.773  1.00  0.00           H  
HETATM   61  H   UNK A   1       4.276  -0.313   0.823  1.00  0.00           H  
HETATM   62  H   UNK A   1      -3.935   1.143   2.823  1.00  0.00           H  
HETATM   63  H   UNK A   1       3.126   2.513   0.895  1.00  0.00           H  
HETATM   64  H   UNK A   1       2.418  -4.881  -1.781  1.00  0.00           H  
HETATM   65  H   UNK A   1      -5.395   0.339   2.198  1.00  0.00           H  
HETATM   66  H   UNK A   1       2.147   0.071  -0.372  1.00  0.00           H  
HETATM   67  H   UNK A   1       4.210  -5.859  -0.403  1.00  0.00           H  
HETATM   68  H   UNK A   1       4.784  -4.848   1.768  1.00  0.00           H  
HETATM   69  H   UNK A   1      -3.346  -1.437   2.513  1.00  0.00           H  
ATOM     70  H   GLY A   2       5.806   2.659   0.650  1.00  0.00           H  
HETATM   71  H   UNK A   1       3.570  -2.857   2.559  1.00  0.00           H  
HETATM   72  H   UNK A   1      -1.534  -1.360   0.236  1.00  0.00           H  
HETATM   73  H   UNK A   1       0.405   0.656  -2.343  1.00  0.00           H  
ATOM     74  HA1 GLY A   2       6.940   1.905  -1.825  1.00  0.00           H  
HETATM   75  H   UNK A   1      -0.458   0.624  -0.787  1.00  0.00           H  
ATOM     76  HA2 GLY A   2       6.244   3.534  -2.000  1.00  0.00           H  
HETATM   77  H   UNK A   1      -2.000  -3.474   2.387  1.00  0.00           H  
HETATM   78  H   UNK A   1      -1.149   2.982  -1.122  1.00  0.00           H  
HETATM   79  H   UNK A   1      -0.688  -3.507   1.184  1.00  0.00           H  
HETATM   80  H   UNK A   1      -0.286   3.013  -2.679  1.00  0.00           H  
HETATM   81  H   UNK A   1      -4.429   4.109  -2.386  1.00  0.00           H  
ATOM     82  HXT GLY A   2       9.674   4.150  -0.856  1.00  0.00           H  
ATOM     83  HXT GLY A   2      -2.001  -6.873  -4.007  1.00  0.00           H  
HETATM   84  H   UNK A   1      -5.106   6.094   0.652  1.00  0.00           H  
CONECT    1   50   53    2                                            
CONECT    2    1    3   44   56                                       
CONECT    3    2   60   57    4                                       
CONECT    4    3   62   65    5                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5   69    8                                            
CONECT    8    7   72    9   37                                       
CONECT    9    8   10   77   79                                       
CONECT   10    9   47                                                 
CONECT   11   12   47                                                 
CONECT   12   11   61   58   13                                       
CONECT   13   12   24   63   14                                       
CONECT   14   13   66   15                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   73   75   18                                       
CONECT   18   17   78   19   80                                       
CONECT   19   18   48   21   20                                       
CONECT   20   19   51   54                                            
CONECT   21   19   23   23   22                                       
CONECT   22   21   81                                                 
CONECT   23   21   21                                                 
CONECT   24   13   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   70                                            
CONECT   27   26   76   74   28                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   82                                                 
CONECT   31   36   36   32   47                                       
CONECT   32   31   33   33   59                                       
CONECT   33   32   32   34   64                                       
CONECT   34   33   67   35   35                                       
CONECT   35   34   34   68   36                                       
CONECT   36   31   31   35   71                                       
CONECT   37    8   39   38   38                                       
CONECT   38   37   37                                                 
CONECT   39   37   49   40                                            
CONECT   40   39   55   41   52                                       
CONECT   41   40   43   43   42                                       
CONECT   42   41   83                                                 
CONECT   43   41   41                                                 
CONECT   44    2   46   46   45                                       
CONECT   45   44   84                                                 
CONECT   46   44   44                                                 
CONECT   47   10   11   31                                            
CONECT   48   19                                                      
CONECT   49   39                                                      
CONECT   50    1                                                      
CONECT   51   20                                                      
CONECT   52   40                                                      
CONECT   53    1                                                      
CONECT   54   20                                                      
CONECT   55   40                                                      
CONECT   56    2                                                      
CONECT   57    3                                                      
CONECT   58   12                                                      
CONECT   59   32                                                      
CONECT   60    3                                                      
CONECT   61   12                                                      
CONECT   62    4                                                      
CONECT   63   13                                                      
CONECT   64   33                                                      
CONECT   65    4                                                      
CONECT   66   14                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69    7                                                      
CONECT   70   26                                                      
CONECT   71   36                                                      
CONECT   72    8                                                      
CONECT   73   17                                                      
CONECT   74   27                                                      
CONECT   75   17                                                      
CONECT   76   27                                                      
CONECT   77    9                                                      
CONECT   78   18                                                      
CONECT   79    9                                                      
CONECT   80   18                                                      
CONECT   81   22                                                      
CONECT   82   30                                                      
CONECT   83   42                                                      
CONECT   84   45                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
