COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -2.467   0.663  -4.957  1.00  0.00           C  
HETATM    2  C   UNK A   0      -1.602  -0.611  -4.802  1.00  0.00           C  
HETATM    3  N   UNK A   0      -0.325  -0.135  -4.240  1.00  0.00           N  
HETATM    4  C   UNK A   0      -0.158   1.284  -4.584  1.00  0.00           C  
HETATM    5  C   UNK A   0      -1.405   1.710  -5.387  1.00  0.00           C  
HETATM    6  C   UNK A   0       1.078   1.461  -5.427  1.00  0.00           C  
HETATM    7  O   UNK A   0       1.496   0.539  -6.087  1.00  0.00           O  
HETATM    8  O   UNK A   0       1.715   2.642  -5.445  1.00  0.00           O  
HETATM    9  S   UNK A   0       0.741  -1.046  -3.359  1.00  0.00           S  
HETATM   10  C   UNK A   0       0.210  -1.002  -1.680  1.00  0.00           C  
HETATM   11  O   UNK A   0       1.973  -0.339  -3.394  1.00  0.00           O  
HETATM   12  O   UNK A   0       0.550  -2.387  -3.790  1.00  0.00           O  
HETATM   13  C   UNK A   0      -0.722  -1.919  -1.228  1.00  0.00           C  
HETATM   14  C   UNK A   0      -1.141  -1.890   0.085  1.00  0.00           C  
HETATM   15  C   UNK A   0      -0.622  -0.934   0.959  1.00  0.00           C  
HETATM   16  C   UNK A   0       0.313  -0.009   0.496  1.00  0.00           C  
HETATM   17  C   UNK A   0       0.728  -0.052  -0.818  1.00  0.00           C  
HETATM   18  C   UNK A   0      -1.067  -0.897   2.369  1.00  0.00           C  
ATOM     19  N   GLU A   1      -0.564   0.027   3.210  1.00  0.00           N  
ATOM     20  CA  GLU A   1      -1.005   0.063   4.607  1.00  0.00           C  
ATOM     21  CB  GLU A   1       0.128   0.595   5.486  1.00  0.00           C  
ATOM     22  CG  GLU A   1       1.345  -0.323   5.359  1.00  0.00           C  
ATOM     23  CD  GLU A   1       2.462   0.200   6.225  1.00  0.00           C  
HETATM   24  O   UNK A   0      -1.887  -1.701   2.768  1.00  0.00           O  
ATOM     25  C   GLU A   1      -2.204   0.968   4.732  1.00  0.00           C  
ATOM     26  O   GLU A   1      -3.035   0.755   5.582  1.00  0.00           O  
ATOM     27  OXT GLU A   1      -2.348   2.010   3.898  1.00  0.00           O  
ATOM     28  OE1 GLU A   1       3.635  -0.449   6.272  1.00  0.00           O  
ATOM     29  OE2 GLU A   1       2.301   1.204   6.877  1.00  0.00           O  
HETATM   30  H   UNK A   0      -3.222   0.532  -5.732  1.00  0.00           H  
HETATM   31  H   UNK A   0      -2.927   0.941  -4.008  1.00  0.00           H  
HETATM   32  H   UNK A   0      -1.438  -1.079  -5.773  1.00  0.00           H  
HETATM   33  H   UNK A   0      -2.079  -1.313  -4.118  1.00  0.00           H  
HETATM   34  H   UNK A   0      -0.078   1.883  -3.678  1.00  0.00           H  
HETATM   35  H   UNK A   0      -1.218   1.650  -6.459  1.00  0.00           H  
HETATM   36  H   UNK A   0      -1.718   2.715  -5.104  1.00  0.00           H  
HETATM   37  H   UNK A   0       2.508   2.756  -5.985  1.00  0.00           H  
HETATM   38  H   UNK A   0      -1.123  -2.658  -1.906  1.00  0.00           H  
HETATM   39  H   UNK A   0      -1.869  -2.606   0.437  1.00  0.00           H  
HETATM   40  H   UNK A   0       0.719   0.733   1.167  1.00  0.00           H  
HETATM   41  H   UNK A   0       1.456   0.660  -1.177  1.00  0.00           H  
ATOM     42  H   GLU A   1       0.089   0.668   2.891  1.00  0.00           H  
ATOM     43  HA  GLU A   1      -1.274  -0.942   4.929  1.00  0.00           H  
ATOM     44  HB1 GLU A   1      -0.199   0.622   6.525  1.00  0.00           H  
ATOM     45  HB2 GLU A   1       0.397   1.601   5.164  1.00  0.00           H  
ATOM     46  HG1 GLU A   1       1.673  -0.350   4.320  1.00  0.00           H  
ATOM     47  HG2 GLU A   1       1.076  -1.329   5.682  1.00  0.00           H  
ATOM     48  HXT GLU A   1      -3.117   2.590   3.978  1.00  0.00           H  
ATOM     49  HE1 GLU A   1       4.352  -0.113   6.828  1.00  0.00           H  
CONECT    1    2    5   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    2    4    9                                            
CONECT    4    3    5    6   34                                       
CONECT    5    1    4   35   36                                       
CONECT    6    4    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6   37                                                 
CONECT    9    3   10   11   11                                       
CONECT    9   12   12                                                 
CONECT   10    9   13   13   17                                       
CONECT   11    9    9                                                 
CONECT   12    9    9                                                 
CONECT   13   10   10   14   38                                       
CONECT   14   13   15   15   39                                       
CONECT   15   14   14   16   18                                       
CONECT   16   15   17   17   40                                       
CONECT   17   10   16   16   41                                       
CONECT   18   15   19   24   24                                       
CONECT   19   18   20   42                                            
CONECT   20   19   21   25   43                                       
CONECT   21   20   22   44   45                                       
CONECT   22   21   23   46   47                                       
CONECT   23   22   28   29   29                                       
CONECT   24   18   18                                                 
CONECT   25   20   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   48                                                 
CONECT   28   23   49                                                 
CONECT   29   23   23                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
