COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNK A   0      -6.478  -1.710  -0.239  1.00  0.00           P  
HETATM    2  O   UNK A   0      -6.031  -2.050  -1.609  1.00  0.00           O  
HETATM    3  O   UNK A   0      -6.850  -3.060   0.554  1.00  0.00           O  
HETATM    4  O   UNK A   0      -7.774  -0.759  -0.318  1.00  0.00           O  
HETATM    5  O   UNK A   0      -5.294  -0.941   0.535  1.00  0.00           O  
HETATM    6  C   UNK A   0      -4.929   0.178  -0.275  1.00  0.00           C  
HETATM    7  C   UNK A   0      -3.803   0.956   0.408  1.00  0.00           C  
HETATM    8  O   UNK A   0      -2.596   0.159   0.454  1.00  0.00           O  
HETATM    9  C   UNK A   0      -1.520   1.104   0.639  1.00  0.00           C  
HETATM   10  N   UNK A   0      -0.245   0.516   0.221  1.00  0.00           N  
HETATM   11  C   UNK A   0       1.006   0.939   0.595  1.00  0.00           C  
HETATM   12  N   UNK A   0       1.474   1.902   1.382  1.00  0.00           N  
HETATM   13  C   UNK A   0       2.770   2.058   1.553  1.00  0.00           C  
HETATM   14  N   UNK A   0       3.661   1.278   0.969  1.00  0.00           N  
HETATM   15  C   UNK A   0       3.287   0.285   0.168  1.00  0.00           C  
ATOM     16  N   ASP A   1       4.228  -0.527  -0.440  1.00  0.00           N  
ATOM     17  CA  ASP A   1       5.655  -0.296  -0.206  1.00  0.00           C  
ATOM     18  C   ASP A   1       6.158   0.756  -1.159  1.00  0.00           C  
ATOM     19  CB  ASP A   1       6.426  -1.599  -0.431  1.00  0.00           C  
ATOM     20  CG  ASP A   1       6.010  -2.614   0.602  1.00  0.00           C  
ATOM     21  O   ASP A   1       7.446   1.132  -1.126  1.00  0.00           O  
ATOM     22  OXT ASP A   1       5.401   1.262  -1.954  1.00  0.00           O  
ATOM     23  OD1 ASP A   1       6.559  -3.839   0.599  1.00  0.00           O  
ATOM     24  OD2 ASP A   1       5.183  -2.325   1.434  1.00  0.00           O  
HETATM   25  C   UNK A   0       1.913   0.079  -0.046  1.00  0.00           C  
HETATM   26  N   UNK A   0       1.184  -0.803  -0.771  1.00  0.00           N  
HETATM   27  C   UNK A   0      -0.083  -0.548  -0.615  1.00  0.00           C  
HETATM   28  C   UNK A   0      -1.884   2.300  -0.268  1.00  0.00           C  
HETATM   29  O   UNK A   0      -1.522   3.534   0.355  1.00  0.00           O  
HETATM   30  C   UNK A   0      -3.418   2.201  -0.422  1.00  0.00           C  
HETATM   31  O   UNK A   0      -4.051   3.369   0.104  1.00  0.00           O  
HETATM   32  H   UNK A   0       0.000   0.000   0.000  1.00  0.00           H  
HETATM   33  H   UNK A   0      -7.561  -3.489   0.058  1.00  0.00           H  
HETATM   34  H   UNK A   0      -5.794   0.830  -0.404  1.00  0.00           H  
HETATM   35  H   UNK A   0      -4.590  -0.173  -1.249  1.00  0.00           H  
HETATM   36  H   UNK A   0      -4.101   1.251   1.414  1.00  0.00           H  
HETATM   37  H   UNK A   0      -1.468   1.421   1.681  1.00  0.00           H  
HETATM   38  H   UNK A   0       3.118   2.853   2.196  1.00  0.00           H  
ATOM     39  H   ASP A   1       3.942  -1.248  -1.023  1.00  0.00           H  
ATOM     40  HA  ASP A   1       5.805   0.041   0.820  1.00  0.00           H  
ATOM     41  HB1 ASP A   1       6.206  -1.983  -1.427  1.00  0.00           H  
ATOM     42  HB2 ASP A   1       7.495  -1.408  -0.344  1.00  0.00           H  
ATOM     43  HXT ASP A   1       0.000   0.000   0.000  1.00  0.00           H  
ATOM     44  HD1 ASP A   1       6.293  -4.490   1.262  1.00  0.00           H  
HETATM   45  H   UNK A   0      -0.887  -1.098  -1.081  1.00  0.00           H  
HETATM   46  H   UNK A   0      -1.396   2.205  -1.239  1.00  0.00           H  
HETATM   47  H   UNK A   0      -1.828   4.242  -0.228  1.00  0.00           H  
HETATM   48  H   UNK A   0      -3.689   2.060  -1.469  1.00  0.00           H  
HETATM   49  H   UNK A   0      -3.751   4.115  -0.433  1.00  0.00           H  
CONECT    1    2    3    4    4                                       
CONECT    1    5                                                      
CONECT    2    1   32                                                 
CONECT    3    1   33                                                 
CONECT    4    1    1                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7   34   35                                       
CONECT    7    6    8   30   36                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   28   37                                       
CONECT   10    9   11   27                                            
CONECT   11   10   12   12   25                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14   14   38                                       
CONECT   14   13   13   15                                            
CONECT   15   14   16   25   25                                       
CONECT   16   15   17   39                                            
CONECT   17   16   18   19   40                                       
CONECT   18   17   21   21   22                                       
CONECT   19   17   20   41   42                                       
CONECT   20   19   23   24   24                                       
CONECT   21   18   18                                                 
CONECT   22   18   43                                                 
CONECT   23   20   44                                                 
CONECT   24   20   20                                                 
CONECT   25   11   15   15   26                                       
CONECT   26   25   27   27                                            
CONECT   27   10   26   26   45                                       
CONECT   28    9   29   30   46                                       
CONECT   29   28   47                                                 
CONECT   30    7   28   31   48                                       
CONECT   31   30   49                                                 
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   13                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
