HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: ODE                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -2.179   3.654   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -3.325   4.683   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -4.789   4.205   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      -5.935   5.234   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      -5.107   2.698   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -3.961   1.669   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -2.497   2.147   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.351   1.119   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -0.156   1.959   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -0.455   3.481   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       1.329   1.090   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.800   1.546   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       3.141   3.048   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0       3.930   0.500   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       5.401   0.955   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.531  -0.091   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       0.778  -0.077   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       1.278  -1.534   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       0.266  -2.695   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0       2.789  -1.830   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       3.289  -3.286   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       4.800  -3.582   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -0.585   0.614   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -2.033  -0.114   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -3.143  -1.182   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -4.622  -0.755   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -5.732  -1.822   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -5.363  -3.317   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      -6.473  -4.385   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      -3.883  -3.745   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -2.773  -2.677   0.000  0.00  0.00           C+0
HETATM   32  H   UNK     0       0.174   2.998   0.000  0.00  0.00           H+0
HETATM   33  H   UNK     0       1.454   2.173   0.000  0.00  0.00           H+0
HETATM   34  H   UNK     0       1.866  -0.137   0.000  0.00  0.00           H+0
HETATM   35  H   UNK     0      -0.587  -0.476   0.000  0.00  0.00           H+0
CONECT    1    7    2                                                       
CONECT    2    1    3                                                       
CONECT    3    2    5    4                                                  
CONECT    4    3                                                            
CONECT    5    3    6                                                       
CONECT    6    5    7                                                       
CONECT    7    1    6    8                                                  
CONECT    8    7    9   24                                                  
CONECT    9    8   10   11   32                                             
CONECT   10    9   23                                                       
CONECT   11    9   17   12   33                                             
CONECT   12   11   14   13                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15                                                            
CONECT   17   11   18   23   34                                             
CONECT   18   17   20   19                                                  
CONECT   19   18                                                            
CONECT   20   18   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21                                                            
CONECT   23   10   17   24   35                                             
CONECT   24    8   23   25                                                  
CONECT   25   24   31   26                                                  
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   30   29                                                  
CONECT   29   28                                                            
CONECT   30   28   31                                                       
CONECT   31   25   30                                                       
CONECT   32    9                                                            
CONECT   33   11                                                            
CONECT   34   17                                                            
CONECT   35   23                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   76    0
END