COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -0.993   2.631  -0.300  1.00  0.00           C  
HETATM    2  C   UNK A   0      -3.337  -0.493   0.124  1.00  0.00           C  
ATOM      3  CA  GLU A   1      -5.602  -1.329  -0.209  1.00  0.00           C  
HETATM    4  C   UNK A   0      -0.304   1.616   0.233  1.00  0.00           C  
HETATM    5  C   UNK A   0       7.789   0.454  -0.175  1.00  0.00           C  
HETATM    6  C   UNK A   0       6.581   1.924  -1.342  1.00  0.00           C  
HETATM    7  O   UNK A   0      -3.034  -1.582   0.577  1.00  0.00           O  
HETATM    8  C   UNK A   0      -1.027   0.460   0.430  1.00  0.00           C  
HETATM    9  C   UNK A   0       6.168  -1.267   0.315  1.00  0.00           C  
HETATM   10  C   UNK A   0       8.405  -1.416   1.040  1.00  0.00           C  
HETATM   11  C   UNK A   0       7.817   1.691  -0.856  1.00  0.00           C  
HETATM   12  C   UNK A   0       6.481  -0.032  -0.282  1.00  0.00           C  
HETATM   13  C   UNK A   0      -2.334   0.568   0.037  1.00  0.00           C  
ATOM     14  CB  GLU A   1      -6.998  -0.706  -0.136  1.00  0.00           C  
ATOM     15  CG  GLU A   1      -7.135   0.088   1.164  1.00  0.00           C  
ATOM     16  CD  GLU A   1      -8.509   0.701   1.236  1.00  0.00           C  
ATOM     17  C   GLU A   1      -5.508  -2.210  -1.428  1.00  0.00           C  
HETATM   18  C   UNK A   0       4.340   0.784  -1.355  1.00  0.00           C  
HETATM   19  C   UNK A   0       3.488   1.313  -0.199  1.00  0.00           C  
HETATM   20  C   UNK A   0       2.007   1.199  -0.564  1.00  0.00           C  
HETATM   21  C   UNK A   0       1.155   1.728   0.592  1.00  0.00           C  
HETATM   22  F   UNK A   0      -0.499  -0.666   0.956  1.00  0.00           F  
HETATM   23  N   UNK A   0       8.715  -0.267   0.488  1.00  0.00           N  
HETATM   24  N   UNK A   0       7.145  -1.934   0.968  1.00  0.00           N  
HETATM   25  N   UNK A   0       5.758   0.893  -1.006  1.00  0.00           N  
HETATM   26  N   UNK A   0       9.379  -2.120   1.706  1.00  0.00           N  
ATOM     27  N   GLU A   1      -4.597  -0.266  -0.297  1.00  0.00           N  
HETATM   28  O   UNK A   0       5.040  -1.726   0.245  1.00  0.00           O  
ATOM     29  OE2 GLU A   1      -8.857   1.447   2.297  1.00  0.00           O  
ATOM     30  OE1 GLU A   1      -9.299   0.521   0.339  1.00  0.00           O  
ATOM     31  O   GLU A   1      -4.686  -1.975  -2.282  1.00  0.00           O  
ATOM     32  OXT GLU A   1      -6.337  -3.257  -1.564  1.00  0.00           O  
HETATM   33  S   UNK A   0      -2.615   2.189  -0.585  1.00  0.00           S  
HETATM   34  H   UNK A   0      -0.577   3.604  -0.517  1.00  0.00           H  
ATOM     35  HA  GLU A   1      -5.423  -1.925   0.686  1.00  0.00           H  
HETATM   36  H   UNK A   0       6.289   2.795  -1.911  1.00  0.00           H  
HETATM   37  H   UNK A   0       8.675   2.337  -0.967  1.00  0.00           H  
ATOM     38  HB1 GLU A   1      -7.143  -0.040  -0.986  1.00  0.00           H  
ATOM     39  HB2 GLU A   1      -7.749  -1.495  -0.161  1.00  0.00           H  
ATOM     40  HG1 GLU A   1      -6.989  -0.578   2.014  1.00  0.00           H  
ATOM     41  HG2 GLU A   1      -6.383   0.877   1.189  1.00  0.00           H  
HETATM   42  H   UNK A   0       4.091  -0.261  -1.541  1.00  0.00           H  
HETATM   43  H   UNK A   0       4.140   1.370  -2.252  1.00  0.00           H  
HETATM   44  H   UNK A   0       3.688   0.727   0.698  1.00  0.00           H  
HETATM   45  H   UNK A   0       3.737   2.358  -0.013  1.00  0.00           H  
HETATM   46  H   UNK A   0       1.807   1.786  -1.460  1.00  0.00           H  
HETATM   47  H   UNK A   0       1.758   0.154  -0.750  1.00  0.00           H  
HETATM   48  H   UNK A   0       1.404   2.773   0.778  1.00  0.00           H  
HETATM   49  H   UNK A   0       1.355   1.142   1.489  1.00  0.00           H  
HETATM   50  H   UNK A   0       6.950  -2.786   1.387  1.00  0.00           H  
HETATM   51  H   UNK A   0      10.280  -1.766   1.763  1.00  0.00           H  
HETATM   52  H   UNK A   0       9.165  -2.971   2.119  1.00  0.00           H  
ATOM     53  H   GLU A   1      -4.839   0.602  -0.657  1.00  0.00           H  
ATOM     54  HE2 GLU A   1      -9.750   1.819   2.298  1.00  0.00           H  
ATOM     55  HXT GLU A   1      -6.239  -3.793  -2.363  1.00  0.00           H  
CONECT    1   33    4    4   34                                       
CONECT    2    7    7   13   27                                       
CONECT    3   14   17   27   35                                       
CONECT    4    1    1    8   21                                       
CONECT    5   12   12   23   11                                       
CONECT    6   25   11   11   36                                       
CONECT    7    2    2                                                 
CONECT    8   13   13    4   22                                       
CONECT    9   28   28   24   12                                       
CONECT   10   24   26   23   23                                       
CONECT   11    5    6    6   37                                       
CONECT   12    9    5    5   25                                       
CONECT   13   33    2    8    8                                       
CONECT   14    3   15   38   39                                       
CONECT   15   14   16   40   41                                       
CONECT   16   15   30   30   29                                       
CONECT   17   31   31    3   32                                       
CONECT   18   19   25   42   43                                       
CONECT   19   20   18   44   45                                       
CONECT   20   21   19   46   47                                       
CONECT   21    4   20   48   49                                       
CONECT   22    8                                                      
CONECT   23   10   10    5                                            
CONECT   24    9   10   50                                            
CONECT   25   12   18    6                                            
CONECT   26   10   51   52                                            
CONECT   27    2    3   53                                            
CONECT   28    9    9                                                 
CONECT   29   16   54                                                 
CONECT   30   16   16                                                 
CONECT   31   17   17                                                 
CONECT   32   17   55                                                 
CONECT   33   13    1                                                 
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    6                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
