HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 352                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       1.117   3.995   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.147   5.140   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.241  -4.825   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.146  -6.070   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -3.678  -5.909   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -4.305  -4.503   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -3.399  -3.257   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.868  -3.418   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      -1.589  -0.765   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      -0.963  -2.172   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.684   0.481   0.000  0.00  0.00           C+0
HETATM   12  S   UNK     0      -1.160   1.946   0.000  0.00  0.00           S+0
HETATM   13  C   UNK     0       0.086   2.851   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.332   1.946   0.000  0.00  0.00           C+0
HETATM   15  N   UNK     0       0.856   0.481   0.000  0.00  0.00           N+0
HETATM   16  O   UNK     0       2.797   2.421   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -0.944   3.995   0.000  0.00  0.00           C+0
HETATM   18  F   UNK     0      -4.583  -7.155   0.000  0.00  0.00           F+0
HETATM   19  C   UNK     0       0.569  -2.333   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      -0.028   5.026   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       2.261   2.965   0.000  0.00  0.00           C+0
HETATM   22  H   UNK     0      -2.047  -2.058   0.000  0.00  0.00           H+0
CONECT    1    2   13   20   21                                             
CONECT    2    1                                                            
CONECT    3    4    8                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   18                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    3    7   10                                                  
CONECT    9   10   11                                                       
CONECT   10    8    9   19   22                                             
CONECT   11    9   12   15                                                  
CONECT   12   11   13                                                       
CONECT   13    1   12   14   17                                             
CONECT   14   13   15   16                                                  
CONECT   15   11   14                                                       
CONECT   16   14                                                            
CONECT   17   13                                                            
CONECT   18    5                                                            
CONECT   19   10                                                            
CONECT   20    1                                                            
CONECT   21    1                                                            
CONECT   22   10                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   46    0
END