HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 185                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       2.980  -1.124   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       2.980   0.416   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       4.313  -1.894   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.647  -1.124   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.313  -3.434   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       2.980  -4.204   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.646  -3.434   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.646  -1.894   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.312  -1.124   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.646   1.186   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0       0.312   0.416   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0      -1.021   1.186   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0      -2.355   0.416   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0      -1.021   2.726   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0       0.312   3.496   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       0.312   5.036   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       1.646   2.726   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -3.689   1.186   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -5.022   0.416   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -6.356   1.186   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -6.356   2.726   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -5.022   3.496   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -3.689   2.726   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -7.690   3.496   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0      -9.024   4.266   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0       2.980  -5.744   0.000  0.00  0.00           C+0
HETATM   27  N   UNK     0       2.980  -7.284   0.000  0.00  0.00           N+0
HETATM   28  O   UNK     0       1.646   5.806   0.000  0.00  0.00           O+0
HETATM   29 Br   UNK     0       2.980   3.496   0.000  0.00  0.00          Br+0
CONECT    1    2    3    8                                                  
CONECT    2    1   10                                                       
CONECT    3    1    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6                                                       
CONECT    6    5    7   26                                                  
CONECT    7    6    8                                                       
CONECT    8    1    7    9                                                  
CONECT    9    8                                                            
CONECT   10    2   11   17                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12   18                                                       
CONECT   14   12   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15   28                                                       
CONECT   17   10   15   29                                                  
CONECT   18   13   19   23                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22   24                                                  
CONECT   22   21   23                                                       
CONECT   23   18   22                                                       
CONECT   24   21   25                                                       
CONECT   25   24                                                            
CONECT   26    6   27                                                       
CONECT   27   26                                                            
CONECT   28   16                                                            
CONECT   29   17                                                            
MASTER        0    0    0    0    0    0    0    0   29    0   62    0
END