HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 789                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       4.754  -0.105   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.420  -0.875   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.087  -0.105   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.087   1.435   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       3.420   2.205   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.754   1.435   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.622  -0.581   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.283   0.665   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.622   1.911   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -1.823   0.665   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -2.593  -0.669   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -4.133  -0.669   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -4.903   0.665   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -4.133   1.998   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -2.593   1.998   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -6.443   0.665   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       0.146  -2.046   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       6.088  -0.875   0.000  0.00  0.00           O+0
HETATM   19 Br   UNK     0       0.146   3.375   0.000  0.00  0.00          Br+0
CONECT    1    2    6   18                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4    7                                                  
CONECT    4    3    5    9                                                  
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    3    8   17                                                  
CONECT    8    7    9   10                                                  
CONECT    9    4    8   19                                                  
CONECT   10    8   11   15                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14   16                                                  
CONECT   14   13   15                                                       
CONECT   15   10   14                                                       
CONECT   16   13                                                            
CONECT   17    7                                                            
CONECT   18    1                                                            
CONECT   19    9                                                            
MASTER        0    0    0    0    0    0    0    0   19    0   42    0
END