COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.792  -2.389  -0.891  1.00  0.00           N  
HETATM    2  CA  UNL     1      -6.122  -1.906  -0.494  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.172  -2.563  -1.352  1.00  0.00           C  
HETATM    4  OXT UNL     1      -8.448  -2.603  -0.939  1.00  0.00           O  
HETATM    5  C   UNL     1      -6.189  -0.389  -0.677  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.224   0.275   0.272  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.925   0.515  -0.126  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.646   0.646   1.537  1.00  0.00           C  
HETATM    9  O   UNL     1      -6.865  -3.053  -2.414  1.00  0.00           O  
HETATM   10  C   UNL     1       5.423  -0.773  -0.211  1.00  0.00           C  
HETATM   11  C   UNL     1       5.735   0.442  -0.833  1.00  0.00           C  
HETATM   12  C   UNL     1       4.743   1.392  -1.051  1.00  0.00           C  
HETATM   13  C   UNL     1       3.434   1.143  -0.655  1.00  0.00           C  
HETATM   14  C   UNL     1       3.106  -0.073  -0.029  1.00  0.00           C  
HETATM   15  C   UNL     1       4.101  -1.036   0.188  1.00  0.00           C  
HETATM   16  C   UNL     1       2.383   2.159  -0.890  1.00  0.00           C  
HETATM   17  C   UNL     1       0.998   1.894  -0.470  1.00  0.00           C  
HETATM   18  C   UNL     1       0.672   0.671   0.158  1.00  0.00           C  
HETATM   19  C   UNL     1       1.716  -0.338   0.392  1.00  0.00           C  
HETATM   20  C   UNL     1       0.003   2.850  -0.691  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.311   2.595  -0.291  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.636   1.390   0.329  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.644   0.423   0.555  1.00  0.00           C  
HETATM   24  C   UNL     1       3.764  -2.318   0.845  1.00  0.00           C  
HETATM   25  C   UNL     1       6.479  -1.779   0.019  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.031   1.129   0.751  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.769   1.255   2.414  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.460   1.498   2.031  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.962  -0.748   1.158  1.00  0.00           O  
HETATM   30  O   UNL     1       1.434  -1.391   0.933  1.00  0.00           O  
HETATM   31  O   UNL     1       3.417  -3.271   0.176  1.00  0.00           O  
HETATM   32  O   UNL     1       3.842  -2.429   2.185  1.00  0.00           O  
HETATM   33  O   UNL     1       7.116  -1.765   1.053  1.00  0.00           O  
HETATM   34  O   UNL     1       6.736  -2.713  -0.918  1.00  0.00           O  
HETATM   35  O   UNL     1       7.009   0.694  -1.222  1.00  0.00           O  
HETATM   36  O   UNL     1       2.664   3.212  -1.429  1.00  0.00           O  
HETATM   37  O   UNL     1       0.314   4.025  -1.292  1.00  0.00           O  
HETATM   38  O   UNL     1      -2.276   3.526  -0.507  1.00  0.00           O  
HETATM   39  O   UNL     1      -2.598   2.097   2.893  1.00  0.00           O  
HETATM   40  H1  UNL     1      -4.701  -3.379  -0.719  1.00  0.00           H  
HETATM   41  H2  UNL     1      -4.602  -2.171  -1.858  1.00  0.00           H  
HETATM   42  HA  UNL     1      -6.301  -2.155   0.552  1.00  0.00           H  
HETATM   43  HXT UNL     1      -9.086  -3.035  -1.524  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.923  -0.134  -1.702  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.201  -0.042  -0.467  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.600   0.228  -1.115  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.665   0.458   1.840  1.00  0.00           H  
HETATM   48  H   UNL     1       4.990   2.328  -1.531  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.105   1.543   3.400  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.225  -1.447   0.544  1.00  0.00           H  
HETATM   51  H   UNL     1       3.612  -3.286   2.569  1.00  0.00           H  
HETATM   52  H   UNL     1       7.436  -3.350  -0.722  1.00  0.00           H  
HETATM   53  H   UNL     1       7.208   0.407  -2.124  1.00  0.00           H  
HETATM   54  H   UNL     1       0.233   4.007  -2.256  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.725   3.436  -1.358  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.110   1.479   3.454  1.00  0.00           H  
CONECT    1    2   40   41                                            
CONECT    2    3    5    1   42                                       
CONECT    3    9    9    4    2                                       
CONECT    4    3   43                                                 
CONECT    5    6    2   44   45                                       
CONECT    6    8    8    5    7                                       
CONECT    7    6   26   26   46                                       
CONECT    8   27    6    6   47                                       
CONECT    9    3    3                                                 
CONECT   10   15   15   25   11                                       
CONECT   11   10   12   12   35                                       
CONECT   12   13   11   11   48                                       
CONECT   13   14   14   16   12                                       
CONECT   14   19   15   13   13                                       
CONECT   15   24   14   10   10                                       
CONECT   16   17   13   36   36                                       
CONECT   17   18   18   20   16                                       
CONECT   18   23   19   17   17                                       
CONECT   19   30   30   18   14                                       
CONECT   20   21   21   17   37                                       
CONECT   21   22   38   20   20                                       
CONECT   22   26   23   23   21                                       
CONECT   23   29   22   22   18                                       
CONECT   24   31   31   32   15                                       
CONECT   25   33   33   10   34                                       
CONECT   26   28    7    7   22                                       
CONECT   27    8   28   28   49                                       
CONECT   28   27   27   39   26                                       
CONECT   29   23   50                                                 
CONECT   30   19   19                                                 
CONECT   31   24   24                                                 
CONECT   32   24   51                                                 
CONECT   33   25   25                                                 
CONECT   34   25   52                                                 
CONECT   35   11   53                                                 
CONECT   36   16   16                                                 
CONECT   37   20   54                                                 
CONECT   38   21   55                                                 
CONECT   39   28   56                                                 
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48   12                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   32                                                      
CONECT   52   34                                                      
CONECT   53   35                                                      
CONECT   54   37                                                      
CONECT   55   38                                                      
CONECT   56   39                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
