HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: DFT                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  P   UNK     0      -1.984   5.374   0.000  0.00  0.00           P+0
HETATM    2  O   UNK     0      -1.984   6.914   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0      -3.524   5.374   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      -0.444   5.374   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      -1.984   3.834   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -0.651   3.064   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -0.651   1.524   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       0.595   0.619   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -1.897   0.619   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -3.361   1.095   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0      -1.421  -0.845   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.119  -0.845   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.556  -1.930   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.835  -4.583   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.303  -4.744   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       0.677  -6.151   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       0.398  -3.498   0.000  0.00  0.00           C+0
HETATM   18  F   UNK     0       3.740  -5.829   0.000  0.00  0.00           F+0
HETATM   19  C   UNK     0       3.461  -3.176   0.000  0.00  0.00           C+0
HETATM   20  F   UNK     0       3.182  -0.523   0.000  0.00  0.00           F+0
HETATM   21  C   UNK     0       1.024  -2.091   0.000  0.00  0.00           C+0
HETATM   22  H   UNK     0       0.321   2.019   0.000  0.00  0.00           H+0
HETATM   23  H   UNK     0      -2.067   1.696   0.000  0.00  0.00           H+0
HETATM   24  H   UNK     0       1.196  -0.675   0.000  0.00  0.00           H+0
CONECT    1    2    3    4    5                                             
CONECT    2    1                                                            
CONECT    3    1                                                            
CONECT    4    1                                                            
CONECT    5    1    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9   22                                             
CONECT    8    7   12                                                       
CONECT    9    7   10   11   23                                             
CONECT   10    9                                                            
CONECT   11    9   12                                                       
CONECT   12    8   11   21   24                                             
CONECT   13   19   20   21                                                  
CONECT   14   15   18   19                                                  
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   21                                                       
CONECT   18   14                                                            
CONECT   19   13   14                                                       
CONECT   20   13                                                            
CONECT   21   12   13   17                                                  
CONECT   22    7                                                            
CONECT   23    9                                                            
CONECT   24   12                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   50    0
END