COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0       6.214   2.558   2.479  1.00  0.00           N  
HETATM    2  C   UNK A   0       6.175   3.699   1.756  1.00  0.00           C  
HETATM    3  C   UNK A   0       7.361   4.597   1.891  1.00  0.00           C  
HETATM    4  C   UNK A   0       5.123   4.057   0.928  1.00  0.00           C  
HETATM    5  O   UNK A   0       5.147   5.221   0.227  1.00  0.00           O  
HETATM    6  C   UNK A   0       4.047   3.186   0.840  1.00  0.00           C  
HETATM    7  C   UNK A   0       2.882   3.528  -0.044  1.00  0.00           C  
HETATM    8  C   UNK A   0       4.046   2.004   1.565  1.00  0.00           C  
HETATM    9  C   UNK A   0       5.145   1.737   2.364  1.00  0.00           C  
HETATM   10  C   UNK A   0       2.915   1.036   1.505  1.00  0.00           C  
HETATM   11  O   UNK A   0       3.148   0.098   0.460  1.00  0.00           O  
HETATM   12  P   UNK A   0       2.046  -1.056   0.206  1.00  0.00           P  
HETATM   13  O   UNK A   0       2.364  -2.005  -0.912  1.00  0.00           O  
HETATM   14  O   UNK A   0       0.661  -0.237   0.045  1.00  0.00           O  
HETATM   15  O   UNK A   0       1.905  -1.741   1.664  1.00  0.00           O  
ATOM     16  N   GLU A   1       1.864   4.285   0.667  1.00  0.00           N  
ATOM     17  CA  GLU A   1       0.742   4.599  -0.215  1.00  0.00           C  
ATOM     18  CB  GLU A   1      -0.406   5.300   0.532  1.00  0.00           C  
ATOM     19  CG  GLU A   1      -0.935   4.587   1.780  1.00  0.00           C  
ATOM     20  CD  GLU A   1      -1.572   3.250   1.496  1.00  0.00           C  
ATOM     21  OE2 GLU A   1      -1.520   2.409   2.559  1.00  0.00           O  
ATOM     22  OE1 GLU A   1      -2.073   2.946   0.421  1.00  0.00           O  
ATOM     23  C   GLU A   1       1.268   5.434  -1.368  1.00  0.00           C  
ATOM     24  OXT GLU A   1       0.611   5.169  -2.529  1.00  0.00           O  
ATOM     25  O   GLU A   1       2.172   6.257  -1.295  1.00  0.00           O  
HETATM   26  H   UNK A   0       7.164   5.376   2.637  1.00  0.00           H  
HETATM   27  H   UNK A   0       8.251   4.035   2.200  1.00  0.00           H  
HETATM   28  H   UNK A   0       7.603   5.080   0.937  1.00  0.00           H  
HETATM   29  H   UNK A   0       5.788   5.838   0.617  1.00  0.00           H  
HETATM   30  H   UNK A   0       3.210   4.126  -0.901  1.00  0.00           H  
HETATM   31  H   UNK A   0       2.411   2.622  -0.440  1.00  0.00           H  
HETATM   32  H   UNK A   0       5.205   0.829   2.956  1.00  0.00           H  
HETATM   33  H   UNK A   0       2.805   0.486   2.450  1.00  0.00           H  
HETATM   34  H   UNK A   0       1.962   1.548   1.311  1.00  0.00           H  
HETATM   35  H   UNK A   0      -0.157  -0.728  -0.185  1.00  0.00           H  
HETATM   36  H   UNK A   0       1.351  -2.545   1.760  1.00  0.00           H  
ATOM     37  H   GLU A   1       2.267   5.153   1.013  1.00  0.00           H  
ATOM     38  HA  GLU A   1       0.378   3.651  -0.627  1.00  0.00           H  
ATOM     39  HB1 GLU A   1      -1.229   5.479  -0.171  1.00  0.00           H  
ATOM     40  HB2 GLU A   1      -0.057   6.292   0.847  1.00  0.00           H  
ATOM     41  HG1 GLU A   1      -0.142   4.444   2.522  1.00  0.00           H  
ATOM     42  HG2 GLU A   1      -1.691   5.212   2.272  1.00  0.00           H  
ATOM     43  HE2 GLU A   1      -1.917   1.524   2.410  1.00  0.00           H  
ATOM     44  HXT GLU A   1       0.912   5.684  -3.307  1.00  0.00           H  
CONECT    1    2    2    9                                            
CONECT    2    4    3    1    1                                       
CONECT    3    2   26   27   28                                       
CONECT    4    5    6    6    2                                       
CONECT    5    4   29                                                 
CONECT    6    7    4    4    8                                       
CONECT    7   16    6   30   31                                       
CONECT    8    6   10    9    9                                       
CONECT    9    8    8    1   32                                       
CONECT   10   11    8   33   34                                       
CONECT   11   12   10                                                 
CONECT   12   13   13   14   11                                       
CONECT   12   15                                                      
CONECT   13   12   12                                                 
CONECT   14   12   35                                                 
CONECT   15   12   36                                                 
CONECT   16   17    7   37                                            
CONECT   17   18   23   16   38                                       
CONECT   18   17   19   39   40                                       
CONECT   19   18   20   41   42                                       
CONECT   20   19   22   22   21                                       
CONECT   21   20   43                                                 
CONECT   22   20   20                                                 
CONECT   23   17   25   25   24                                       
CONECT   24   23   44                                                 
CONECT   25   23   23                                                 
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
