COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -3.864   0.515   1.232  1.00  0.00           C  
HETATM    2  C   UNK A   0      -2.741   0.495   0.193  1.00  0.00           C  
HETATM    3  N   UNK A   0      -1.446   0.578   0.872  1.00  0.00           N  
HETATM    4  C   UNK A   0      -7.020  -0.311  -0.414  1.00  0.00           C  
HETATM    5  C   UNK A   0      -7.933  -1.272  -0.859  1.00  0.00           C  
HETATM    6  C   UNK A   0      -7.673  -2.599  -0.665  1.00  0.00           C  
HETATM    7  C   UNK A   0      -6.510  -3.006  -0.028  1.00  0.00           C  
HETATM    8  C   UNK A   0      -5.595  -2.076   0.419  1.00  0.00           C  
HETATM    9  C   UNK A   0      -5.845  -0.723   0.236  1.00  0.00           C  
HETATM   10  N   UNK A   0      -6.994   1.046  -0.458  1.00  0.00           N  
HETATM   11  N   UNK A   0      -5.160   0.433   0.553  1.00  0.00           N  
HETATM   12  C   UNK A   0      -5.903   1.480   0.104  1.00  0.00           C  
HETATM   13  C   UNK A   0      -5.515   2.931   0.230  1.00  0.00           C  
HETATM   14  C   UNK A   0      -0.306   0.577   0.153  1.00  0.00           C  
HETATM   15  O   UNK A   0      -0.353   0.507  -1.057  1.00  0.00           O  
HETATM   16  C   UNK A   0       1.026   0.662   0.852  1.00  0.00           C  
HETATM   17  C   UNK A   0       2.151   0.548  -0.179  1.00  0.00           C  
HETATM   18  C   UNK A   0       2.142   1.784  -1.082  1.00  0.00           C  
HETATM   19  C   UNK A   0       3.476   0.454   0.532  1.00  0.00           C  
HETATM   20  O   UNK A   0       3.570   0.805   1.689  1.00  0.00           O  
HETATM   21  C   UNK A   0       2.494   3.022  -0.254  1.00  0.00           C  
HETATM   22  C   UNK A   0       3.174   1.607  -2.198  1.00  0.00           C  
ATOM     23  C   ASP A   1       6.599   1.088   0.647  1.00  0.00           C  
ATOM     24  N   ASP A   1       4.557  -0.020  -0.119  1.00  0.00           N  
ATOM     25  O   ASP A   1       6.981   1.459  -0.679  1.00  0.00           O  
ATOM     26  CA  ASP A   1       5.815  -0.225   0.604  1.00  0.00           C  
ATOM     27  CB  ASP A   1       6.646  -1.292  -0.111  1.00  0.00           C  
ATOM     28  CG  ASP A   1       5.929  -2.615  -0.046  1.00  0.00           C  
ATOM     29  OD2 ASP A   1       6.474  -3.703  -0.612  1.00  0.00           O  
ATOM     30  OD1 ASP A   1       4.861  -2.697   0.515  1.00  0.00           O  
HETATM   31  H   UNK A   0      -3.752  -0.335   1.905  1.00  0.00           H  
HETATM   32  H   UNK A   0      -3.813   1.441   1.805  1.00  0.00           H  
HETATM   33  H   UNK A   0      -2.793  -0.431  -0.380  1.00  0.00           H  
HETATM   34  H   UNK A   0      -2.854   1.346  -0.480  1.00  0.00           H  
HETATM   35  H   UNK A   0      -1.409   0.634   1.840  1.00  0.00           H  
HETATM   36  H   UNK A   0      -8.842  -0.965  -1.355  1.00  0.00           H  
HETATM   37  H   UNK A   0      -8.381  -3.338  -1.010  1.00  0.00           H  
HETATM   38  H   UNK A   0      -6.319  -4.059   0.118  1.00  0.00           H  
HETATM   39  H   UNK A   0      -4.691  -2.399   0.914  1.00  0.00           H  
HETATM   40  H   UNK A   0      -4.943   3.231  -0.647  1.00  0.00           H  
HETATM   41  H   UNK A   0      -6.415   3.542   0.304  1.00  0.00           H  
HETATM   42  H   UNK A   0      -4.908   3.068   1.125  1.00  0.00           H  
HETATM   43  H   UNK A   0       1.104   1.618   1.370  1.00  0.00           H  
HETATM   44  H   UNK A   0       1.111  -0.151   1.573  1.00  0.00           H  
HETATM   45  H   UNK A   0       1.999  -0.345  -0.785  1.00  0.00           H  
HETATM   46  H   UNK A   0       1.152   1.908  -1.518  1.00  0.00           H  
HETATM   47  H   UNK A   0       3.517   2.936   0.111  1.00  0.00           H  
HETATM   48  H   UNK A   0       2.404   3.912  -0.876  1.00  0.00           H  
HETATM   49  H   UNK A   0       1.811   3.099   0.592  1.00  0.00           H  
HETATM   50  H   UNK A   0       2.926   0.722  -2.784  1.00  0.00           H  
HETATM   51  H   UNK A   0       3.164   2.485  -2.844  1.00  0.00           H  
HETATM   52  H   UNK A   0       4.165   1.489  -1.761  1.00  0.00           H  
ATOM     53  H1  ASP A   1       5.973   1.871   1.077  1.00  0.00           H  
ATOM     54  H2  ASP A   1       7.491   0.959   1.260  1.00  0.00           H  
ATOM     55  H   ASP A   1       4.503  -0.225  -1.065  1.00  0.00           H  
ATOM     56  H   ASP A   1       7.483   2.284  -0.728  1.00  0.00           H  
ATOM     57  HA  ASP A   1       5.600  -0.553   1.621  1.00  0.00           H  
ATOM     58  HB1 ASP A   1       6.786  -1.005  -1.154  1.00  0.00           H  
ATOM     59  HB2 ASP A   1       7.618  -1.381   0.374  1.00  0.00           H  
ATOM     60  HD2 ASP A   1       5.977  -4.530  -0.544  1.00  0.00           H  
CONECT    1    2   11   31   32                                       
CONECT    2    1    3   33   34                                       
CONECT    3    2   14   35                                            
CONECT    4    9    9    5   10                                       
CONECT    5    4    6    6   36                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   38                                       
CONECT    8    7    7    9   39                                       
CONECT    9    4    4    8   11                                       
CONECT   10    4   12   12                                            
CONECT   11    1    9   12                                            
CONECT   12   10   10   11   13                                       
CONECT   13   12   40   41   42                                       
CONECT   14    3   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   43   44                                       
CONECT   17   16   19   18   45                                       
CONECT   18   17   21   22   46                                       
CONECT   19   17   20   20   24                                       
CONECT   20   19   19                                                 
CONECT   21   18   47   48   49                                       
CONECT   22   18   50   51   52                                       
CONECT   23   26   25   53   54                                       
CONECT   24   19   26   55                                            
CONECT   25   23   56                                                 
CONECT   26   24   27   23   57                                       
CONECT   27   26   28   58   59                                       
CONECT   28   27   30   30   29                                       
CONECT   29   28   60                                                 
CONECT   30   28   28                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
