HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 785                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       5.125   0.938   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.125  -0.602   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.791  -1.372   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.458  -0.602   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.458   0.938   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.791   1.708   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       6.459   1.708   0.000  0.00  0.00           C+0
HETATM    8  N   UNK     0       7.792   0.938   0.000  0.00  0.00           N+0
HETATM    9  N   UNK     0       6.459   3.248   0.000  0.00  0.00           N+1
HETATM   10  N   UNK     0       0.993  -1.078   0.000  0.00  0.00           N+0
HETATM   11  N   UNK     0       0.993   1.414   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0       0.088   0.168   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -1.452   0.168   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -2.222  -1.166   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -3.762  -1.166   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -4.532  -2.500   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -3.762  -3.833   0.000  0.00  0.00           C+0
HETATM   18  F   UNK     0      -2.992  -5.167   0.000  0.00  0.00           F+0
HETATM   19  F   UNK     0      -5.096  -4.603   0.000  0.00  0.00           F+0
HETATM   20  F   UNK     0      -2.429  -3.063   0.000  0.00  0.00           F+0
HETATM   21  C   UNK     0      -4.532   0.168   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -3.762   1.502   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -2.222   1.502   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      -1.452   2.835   0.000  0.00  0.00           O-1
CONECT    1    2    6    7                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   10                                                  
CONECT    5    4    6   11                                                  
CONECT    6    1    5                                                       
CONECT    7    1    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7                                                            
CONECT   10    4   12                                                       
CONECT   11    5   12                                                       
CONECT   12   10   11   13                                                  
CONECT   13   12   14   23                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   21                                                  
CONECT   16   15   17                                                       
CONECT   17   16   18   19   20                                             
CONECT   18   17                                                            
CONECT   19   17                                                            
CONECT   20   17                                                            
CONECT   21   15   22                                                       
CONECT   22   21   23                                                       
CONECT   23   13   22   24                                                  
CONECT   24   23                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   52    0
END