HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: ChEBI                                             
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      13.319 -25.260   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      15.358 -25.260   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      16.464 -24.189   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      14.412 -23.381   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      12.034 -24.177   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      15.350 -26.279   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0      13.325 -26.279   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0      12.029 -23.171   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      10.928 -22.531   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      15.042 -18.480   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      15.042 -20.020   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      13.708 -17.710   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0      13.708 -20.790   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0      12.375 -18.480   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0      12.375 -20.020   0.000  0.00  0.00           C+0
HETATM   16  N   UNK     0      16.507 -20.496   0.000  0.00  0.00           N+0
HETATM   17  C   UNK     0      17.412 -19.250   0.000  0.00  0.00           C+0
HETATM   18  N   UNK     0      16.507 -18.004   0.000  0.00  0.00           N+1
HETATM   19  N   UNK     0      11.041 -20.790   0.000  0.00  0.00           N+0
HETATM   20  O   UNK     0      13.708 -16.170   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      16.500 -16.280   0.000  0.00  0.00           C+0
HETATM   22  P   UNK     0       9.470 -23.368   0.000  0.00  0.00           P+0
HETATM   23  O   UNK     0       8.013 -24.204   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      10.307 -24.825   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       8.634 -21.910   0.000  0.00  0.00           O+0
CONECT    1    2    5    7                                                  
CONECT    2    1    3    6                                                  
CONECT    3    4    2   16                                                  
CONECT    4    3    5                                                       
CONECT    5    1    4    8                                                  
CONECT    6    2                                                            
CONECT    7    1                                                            
CONECT    8    5    9                                                       
CONECT    9    8   22                                                       
CONECT   10   12   11   18                                                  
CONECT   11   13   16   10                                                  
CONECT   12   10   14   20                                                  
CONECT   13   11   15                                                       
CONECT   14   12   15                                                       
CONECT   15   13   14   19                                                  
CONECT   16   17   11    3                                                  
CONECT   17   16   18                                                       
CONECT   18   17   10   21                                                  
CONECT   19   15                                                            
CONECT   20   12                                                            
CONECT   21   18                                                            
CONECT   22   23   24   25    9                                             
CONECT   23   22                                                            
CONECT   24   22                                                            
CONECT   25   22                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   54    0
END