COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  CA  ASP A   2       4.595   0.660   0.300  1.00  0.00           C  
ATOM      2  C   ASP A   2       5.091   0.428   1.704  1.00  0.00           C  
HETATM    3  C   UNK A   1      -2.615   1.273   0.401  1.00  0.00           C  
HETATM    4  C   UNK A   1      -3.883   0.727   0.251  1.00  0.00           C  
HETATM    5  C   UNK A   1      -4.030  -0.613  -0.085  1.00  0.00           C  
HETATM    6  C   UNK A   1       0.528  -3.839  -0.838  1.00  0.00           C  
HETATM    7  C   UNK A   1      -0.596  -3.056  -0.652  1.00  0.00           C  
HETATM    8  C   UNK A   1      -0.442  -1.707  -0.318  1.00  0.00           C  
HETATM    9  N   UNK A   1       0.763  -1.180  -0.179  1.00  0.00           N  
HETATM   10  C   UNK A   1       1.861  -1.905  -0.351  1.00  0.00           C  
HETATM   11  C   UNK A   1       1.778  -3.254  -0.685  1.00  0.00           C  
HETATM   12  C   UNK A   1       3.191  -1.271  -0.186  1.00  0.00           C  
HETATM   13  O   UNK A   1       4.201  -1.929  -0.341  1.00  0.00           O  
ATOM     14  N   ASP A   2       3.280   0.034   0.137  1.00  0.00           N  
ATOM     15  CB  ASP A   2       4.479   2.164   0.042  1.00  0.00           C  
ATOM     16  CG  ASP A   2       4.101   2.399  -1.398  1.00  0.00           C  
ATOM     17  OD1 ASP A   2       3.941   1.460  -2.141  1.00  0.00           O  
ATOM     18  OD2 ASP A   2       3.943   3.651  -1.854  1.00  0.00           O  
ATOM     19  OXT ASP A   2       6.283   0.915   2.084  1.00  0.00           O  
ATOM     20  O   ASP A   2       4.416  -0.197   2.488  1.00  0.00           O  
HETATM   21  C   UNK A   1      -1.642  -0.859  -0.117  1.00  0.00           C  
HETATM   22  C   UNK A   1      -1.498   0.487   0.216  1.00  0.00           C  
HETATM   23  C   UNK A   1      -2.916  -1.404  -0.272  1.00  0.00           C  
HETATM   24  O   UNK A   1      -4.982   1.504   0.435  1.00  0.00           O  
HETATM   25  C   UNK A   1      -6.255   0.877   0.265  1.00  0.00           C  
HETATM   26  F   UNK A   1      -7.269   1.814   0.490  1.00  0.00           F  
HETATM   27  F   UNK A   1      -6.360   0.380  -1.038  1.00  0.00           F  
HETATM   28  F   UNK A   1      -6.382  -0.176   1.178  1.00  0.00           F  
ATOM     29  HA  ASP A   2       5.296   0.223  -0.410  1.00  0.00           H  
HETATM   30  H   UNK A   1      -2.504   2.316   0.659  1.00  0.00           H  
HETATM   31  H   UNK A   1      -5.017  -1.035  -0.201  1.00  0.00           H  
HETATM   32  H   UNK A   1       0.436  -4.884  -1.092  1.00  0.00           H  
HETATM   33  H   UNK A   1      -1.583  -3.481  -0.764  1.00  0.00           H  
HETATM   34  H   UNK A   1       2.675  -3.840  -0.819  1.00  0.00           H  
ATOM     35  H   ASP A   2       2.474   0.559   0.261  1.00  0.00           H  
ATOM     36  HB1 ASP A   2       3.713   2.586   0.692  1.00  0.00           H  
ATOM     37  HB2 ASP A   2       5.436   2.643   0.250  1.00  0.00           H  
ATOM     38  HD2 ASP A   2       3.700   3.752  -2.784  1.00  0.00           H  
ATOM     39  HXT ASP A   2       6.558   0.740   2.994  1.00  0.00           H  
HETATM   40  H   UNK A   1      -0.512   0.913   0.328  1.00  0.00           H  
HETATM   41  H   UNK A   1      -3.031  -2.445  -0.534  1.00  0.00           H  
CONECT    1   15   14    2   29                                       
CONECT    2    1   20   20   19                                       
CONECT    3    4    4   22   30                                       
CONECT    4   24    3    3    5                                       
CONECT    5    4   23   23   31                                       
CONECT    6    7    7   11   32                                       
CONECT    7    8    6    6   33                                       
CONECT    8   21    9    9    7                                       
CONECT    9    8    8   10                                            
CONECT   10    9   12   11   11                                       
CONECT   11   10   10    6   34                                       
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12    1   35                                            
CONECT   15   16    1   36   37                                       
CONECT   16   17   17   15   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   38                                                 
CONECT   19    2   39                                                 
CONECT   20    2    2                                                 
CONECT   21   22   22   23    8                                       
CONECT   22    3   21   21   40                                       
CONECT   23    5    5   21   41                                       
CONECT   24   25    4                                                 
CONECT   25   26   27   24   28                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34   11                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
