HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: IAA                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0       1.504  -5.882   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       1.980  -4.418   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       3.486  -4.098   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0       0.949  -3.273   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       1.425  -1.809   0.000  0.00  0.00           O+0
HETATM    6  N   UNK     0       0.395  -0.664   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0       0.871   0.800   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.034   2.046   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.574   2.046   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.480   3.292   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      -2.004   4.757   0.000  0.00  0.00           O+0
HETATM   12  N   UNK     0      -3.944   2.816   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0      -3.944   1.276   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -5.089   0.246   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -4.769  -1.261   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -3.304  -1.736   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -2.159  -0.706   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -2.480   0.800   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       0.871   3.292   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       2.335   2.816   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       3.669   3.586   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       5.003   2.816   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       5.003   1.276   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       3.669   0.506   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       2.335   1.276   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8   25                                                  
CONECT    8    7    9   19                                                  
CONECT    9    8   10   18                                                  
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14   18                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18    9   13   17                                                  
CONECT   19    8   20                                                       
CONECT   20   19   21   25                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25    7   20   24                                                  
MASTER        0    0    0    0    0    0    0    0   25    0   56    0
END