COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1      -7.360   2.050  -0.603  1.00  0.00           C  
HETATM    2  N   UNK A   1      -6.859   0.995   1.528  1.00  0.00           N  
HETATM    3  C   UNK A   1      -1.062  -2.627   0.301  1.00  0.00           C  
HETATM    4  N   UNK A   1      -1.815  -0.371   0.784  1.00  0.00           N  
HETATM    5  O   UNK A   1      -2.069  -2.980   0.877  1.00  0.00           O  
ATOM      6  C   GLY A   2       0.575  -5.785  -0.710  1.00  0.00           C  
ATOM      7  N   GLY A   2      -0.218  -3.547  -0.206  1.00  0.00           N  
HETATM    8  O   UNK A   1       4.064   2.726   2.409  1.00  0.00           O  
HETATM    9  O   UNK A   1      -8.374   1.394  -0.615  1.00  0.00           O  
HETATM   10  O   UNK A   1      -7.193   3.045  -1.489  1.00  0.00           O  
ATOM     11  O   GLY A   2       1.508  -5.228  -1.239  1.00  0.00           O  
ATOM     12  OXT GLY A   2       0.511  -7.126  -0.701  1.00  0.00           O  
HETATM   13  C   UNK A   1      -6.284   1.754   0.410  1.00  0.00           C  
HETATM   14  C   UNK A   1      -0.753  -1.159   0.153  1.00  0.00           C  
ATOM     15  CA  GLY A   2      -0.517  -4.974  -0.062  1.00  0.00           C  
HETATM   16  C   UNK A   1       2.548   1.089   1.500  1.00  0.00           C  
HETATM   17  C   UNK A   1       2.939   2.563   1.543  1.00  0.00           C  
HETATM   18  C   UNK A   1      -5.175   0.931  -0.249  1.00  0.00           C  
HETATM   19  C   UNK A   1       0.583  -0.848   0.829  1.00  0.00           C  
HETATM   20  C   UNK A   1       3.587   0.281   0.771  1.00  0.00           C  
HETATM   21  C   UNK A   1       3.296   3.062   0.169  1.00  0.00           C  
HETATM   22  C   UNK A   1      -2.934  -0.073   0.094  1.00  0.00           C  
HETATM   23  C   UNK A   1       4.828  -1.747   0.494  1.00  0.00           C  
HETATM   24  C   UNK A   1       3.330   4.813  -1.464  1.00  0.00           C  
HETATM   25  O   UNK A   1      -3.062  -0.458  -1.049  1.00  0.00           O  
HETATM   26  C   UNK A   1       5.479  -1.212  -0.602  1.00  0.00           C  
HETATM   27  C   UNK A   1       3.993   3.985  -2.353  1.00  0.00           C  
HETATM   28  C   UNK A   1      -4.026   0.737   0.743  1.00  0.00           C  
HETATM   29  S   UNK A   1       0.954   0.919   0.650  1.00  0.00           S  
HETATM   30  C   UNK A   1       3.884  -1.004   1.179  1.00  0.00           C  
HETATM   31  C   UNK A   1       2.983   4.353  -0.207  1.00  0.00           C  
HETATM   32  C   UNK A   1       4.252   0.828  -0.324  1.00  0.00           C  
HETATM   33  C   UNK A   1       3.949   2.221  -0.730  1.00  0.00           C  
HETATM   34  C   UNK A   1       5.195   0.075  -1.016  1.00  0.00           C  
HETATM   35  C   UNK A   1       4.304   2.689  -1.991  1.00  0.00           C  
HETATM   36  H   UNK A   1      -7.549   1.542   2.020  1.00  0.00           H  
HETATM   37  H   UNK A   1      -7.251   0.122   1.208  1.00  0.00           H  
HETATM   38  H   UNK A   1      -1.713  -0.063   1.698  1.00  0.00           H  
ATOM     39  H   GLY A   2       0.588  -3.265  -0.666  1.00  0.00           H  
HETATM   40  H   UNK A   1       4.371   3.639   2.487  1.00  0.00           H  
HETATM   41  H   UNK A   1      -7.910   3.196  -2.119  1.00  0.00           H  
ATOM     42  HXT GLY A   2       1.235  -7.602  -1.130  1.00  0.00           H  
HETATM   43  H   UNK A   1      -5.869   2.691   0.782  1.00  0.00           H  
HETATM   44  H   UNK A   1      -0.693  -0.906  -0.905  1.00  0.00           H  
ATOM     45  HA1 GLY A   2      -1.470  -5.196  -0.543  1.00  0.00           H  
ATOM     46  HA2 GLY A   2      -0.578  -5.227   0.997  1.00  0.00           H  
HETATM   47  H   UNK A   1       2.453   0.714   2.519  1.00  0.00           H  
HETATM   48  H   UNK A   1       2.102   3.145   1.929  1.00  0.00           H  
HETATM   49  H   UNK A   1      -5.570  -0.042  -0.542  1.00  0.00           H  
HETATM   50  H   UNK A   1      -4.809   1.456  -1.132  1.00  0.00           H  
HETATM   51  H   UNK A   1       0.523  -1.101   1.888  1.00  0.00           H  
HETATM   52  H   UNK A   1       1.373  -1.434   0.360  1.00  0.00           H  
HETATM   53  H   UNK A   1       5.059  -2.752   0.818  1.00  0.00           H  
HETATM   54  H   UNK A   1       3.083   5.823  -1.754  1.00  0.00           H  
HETATM   55  H   UNK A   1       6.211  -1.801  -1.136  1.00  0.00           H  
HETATM   56  H   UNK A   1       4.268   4.353  -3.330  1.00  0.00           H  
HETATM   57  H   UNK A   1      -3.631   1.710   1.036  1.00  0.00           H  
HETATM   58  H   UNK A   1      -4.392   0.213   1.625  1.00  0.00           H  
HETATM   59  H   UNK A   1       3.378  -1.429   2.034  1.00  0.00           H  
HETATM   60  H   UNK A   1       2.467   5.005   0.482  1.00  0.00           H  
HETATM   61  H   UNK A   1       5.703   0.494  -1.872  1.00  0.00           H  
HETATM   62  H   UNK A   1       4.820   2.041  -2.685  1.00  0.00           H  
CONECT    1    9    9   13   10                                       
CONECT    2   13   36   37                                            
CONECT    3   14    7    5    5                                       
CONECT    4   22   14   38                                            
CONECT    5    3    3                                                 
CONECT    6   11   11   15   12                                       
CONECT    7    3   15   39                                            
CONECT    8   17   40                                                 
CONECT    9    1    1                                                 
CONECT   10    1   41                                                 
CONECT   11    6    6                                                 
CONECT   12    6   42                                                 
CONECT   13    1    2   18   43                                       
CONECT   14    3    4   19   44                                       
CONECT   15    6    7   45   46                                       
CONECT   16   20   29   17   47                                       
CONECT   17    8   16   21   48                                       
CONECT   18   13   28   49   50                                       
CONECT   19   14   29   51   52                                       
CONECT   20   16   30   30   32                                       
CONECT   21   17   33   33   31                                       
CONECT   22    4   28   25   25                                       
CONECT   23   30   26   26   53                                       
CONECT   24   31   31   27   54                                       
CONECT   25   22   22                                                 
CONECT   26   23   23   34   55                                       
CONECT   27   24   35   35   56                                       
CONECT   28   18   22   57   58                                       
CONECT   29   16   19                                                 
CONECT   30   20   20   23   59                                       
CONECT   31   21   24   24   60                                       
CONECT   32   20   34   34   33                                       
CONECT   33   21   21   32   35                                       
CONECT   34   26   32   32   61                                       
CONECT   35   27   27   33   62                                       
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
