HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 872                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -4.047   1.989   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -2.713   2.759   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.380   1.989   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -1.380   0.449   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -2.713  -0.321   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -4.047   0.449   0.000  0.00  0.00           C+0
HETATM    7  F   UNK     0      -2.713  -1.861   0.000  0.00  0.00           F+0
HETATM    8  F   UNK     0      -2.713   4.299   0.000  0.00  0.00           F+0
HETATM    9  C   UNK     0      -0.046   2.759   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.288   1.989   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.621   2.759   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.955   1.989   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0       5.289   2.759   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0       1.288   0.449   0.000  0.00  0.00           N+0
HETATM   15  O   UNK     0       3.955   0.449   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       5.174   4.294   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.303   5.342   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.825   5.112   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       8.595   3.779   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       8.033   2.345   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       6.561   1.891   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       6.332   0.368   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       9.080   1.216   0.000  0.00  0.00           O+0
HETATM   24  F   UNK     0      -5.381  -0.321   0.000  0.00  0.00           F+0
HETATM   25  C   UNK     0       7.536  -0.592   0.000  0.00  0.00           C+0
HETATM   26  F   UNK     0       8.740  -1.552   0.000  0.00  0.00           F+0
HETATM   27  F   UNK     0       8.496   0.612   0.000  0.00  0.00           F+0
HETATM   28  F   UNK     0       6.576  -1.796   0.000  0.00  0.00           F+0
HETATM   29  H   UNK     0       1.288   3.079   0.000  0.00  0.00           H+0
HETATM   30  H   UNK     0       5.562   1.455   0.000  0.00  0.00           H+0
CONECT    1    2    6                                                       
CONECT    2    1    8    3                                                  
CONECT    3    2    9    4                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    1    5   24                                                  
CONECT    7    5                                                            
CONECT    8    2                                                            
CONECT    9    3   10                                                       
CONECT   10    9   11   14   29                                             
CONECT   11   10   12                                                       
CONECT   12   11   13   15                                                  
CONECT   13   12   16   21                                                  
CONECT   14   10                                                            
CONECT   15   12                                                            
CONECT   16   13   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   23                                                  
CONECT   21   13   20   22   30                                             
CONECT   22   21   25                                                       
CONECT   23   20                                                            
CONECT   24    6                                                            
CONECT   25   22   28   26   27                                             
CONECT   26   25                                                            
CONECT   27   25                                                            
CONECT   28   25                                                            
CONECT   29   10                                                            
CONECT   30   21                                                            
MASTER        0    0    0    0    0    0    0    0   30    0   62    0
END