HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 459                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       2.765   2.680   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.125   1.220   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       1.098   0.406   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -0.309   0.097   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -0.136   1.843   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -0.854  -1.092   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.088  -0.300   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.880  -0.280   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       3.552  -0.254   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       5.056   0.270   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       1.967  -2.122   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       0.444  -2.457   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       1.213  -1.373   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.269  -0.953   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -1.373  -2.026   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -2.855  -1.606   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -3.232  -0.112   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0      -4.713   0.308   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0      -2.127   0.961   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.646   0.540   0.000  0.00  0.00           C+0
HETATM   21  H   UNK     0       1.891   2.285   0.000  0.00  0.00           H+0
HETATM   22  H   UNK     0       1.040   1.495   0.000  0.00  0.00           H+0
HETATM   23  H   UNK     0       0.415   0.911   0.000  0.00  0.00           H+0
HETATM   24  H   UNK     0       0.279  -0.810   0.000  0.00  0.00           H+0
CONECT    1    2                                                            
CONECT    2    1    3    8   21                                             
CONECT    3    2    4   13   22                                             
CONECT    4    3    5    6   23                                             
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6    8                                                       
CONECT    8    2    7    9   11                                             
CONECT    9    8   10                                                       
CONECT   10    9                                                            
CONECT   11    8   12                                                       
CONECT   12   11   13                                                       
CONECT   13    3   12   14   24                                             
CONECT   14   13   15   20                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   17   20                                                       
CONECT   20   14   19                                                       
CONECT   21    2                                                            
CONECT   22    3                                                            
CONECT   23    4                                                            
CONECT   24   13                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   52    0
END