HEADER    PROTEIN                                 22-JUN-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   22-JUN-21         0                                  
HETATM    1  O   UNK     0      -1.334  -1.650   0.000  0.00  0.00           O-1
HETATM    2  C   UNK     0       0.000  -0.880   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       1.334  -1.650   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0       0.000   0.660   0.000  0.00  0.00           C+0
HETATM    5  F   UNK     0       0.000   2.200   0.000  0.00  0.00           F+0
HETATM    6  F   UNK     0       1.540   0.660   0.000  0.00  0.00           F+0
HETATM    7  F   UNK     0      -1.540   0.660   0.000  0.00  0.00           F+0
HETATM    8  C   UNK     0       5.940   6.125   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0       7.274   5.355   0.000  0.00  0.00           N+1
HETATM   10  C   UNK     0       6.504   4.021   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.044   6.689   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       8.607   4.585   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       8.607   3.045   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       7.274   2.275   0.000  0.00  0.00           O+0
HETATM   15  N   UNK     0       9.941   2.275   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0       9.941   0.735   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      11.275  -0.035   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      11.275  -1.575   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      12.608  -2.345   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      12.608  -3.885   0.000  0.00  0.00           C+0
HETATM   21  I   UNK     0      13.942  -4.655   0.000  0.00  0.00           I+0
HETATM   22  C   UNK     0      11.275  -4.655   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      11.275  -6.195   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       9.941  -3.885   0.000  0.00  0.00           C+0
HETATM   25 Br   UNK     0       8.607  -4.655   0.000  0.00  0.00          Br+0
HETATM   26  C   UNK     0       9.941  -2.345   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       8.607  -0.035   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0       8.607  -1.575   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       7.274   0.735   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5    6    7                                             
CONECT    5    4                                                            
CONECT    6    4                                                            
CONECT    7    4                                                            
CONECT    8    9                                                            
CONECT    9    8   10   11   12                                             
CONECT   10    9                                                            
CONECT   11    9                                                            
CONECT   12    9   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   17   27                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   26                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24   18                                                       
CONECT   27   16   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27                                                            
MASTER        0    0    0    0    0    0    0    0   29    0   56    0
END