HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: IOK                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -9.797   7.242   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0     -11.131   8.012   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0     -12.464   7.242   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0     -12.464   5.702   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0     -13.798   4.932   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0     -11.131   4.932   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -9.797   5.702   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -8.463   8.012   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -7.130   7.242   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -5.796   8.012   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -5.796   9.552   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0      -4.462   7.242   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0      -3.129   8.012   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      -3.129   9.552   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      -1.795   7.242   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -0.461   8.012   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       0.945   7.385   0.000  0.00  0.00           C+0
HETATM   18  N   UNK     0       1.976   8.530   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0       1.206   9.864   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       1.682  11.328   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       0.651  12.473   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -0.855  12.153   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -1.331  10.688   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -0.300   9.544   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       1.266   5.879   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       2.730   5.403   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       3.051   3.897   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       1.906   2.866   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       0.441   3.342   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       0.121   4.849   0.000  0.00  0.00           C+0
HETATM   31  H   UNK     0      -6.740   8.557   0.000  0.00  0.00           H+0
CONECT    1    7    8    2                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    6    5                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    1    6                                                       
CONECT    8    1    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12   31                                             
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   24   17                                                  
CONECT   17   16   18   25                                                  
CONECT   18   17   19                                                       
CONECT   19   18   24   20                                                  
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   16   19   23                                                  
CONECT   25   17   26   30                                                  
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   29                                                       
CONECT   29   28   30                                                       
CONECT   30   25   29                                                       
CONECT   31   10                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   68    0
END