HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: CXB                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       0.552  -3.789   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       0.552  -2.249   0.000  0.00  0.00           O+0
HETATM    3  N   UNK     0      -0.782  -1.479   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0      -0.782   0.061   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.552   0.831   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       0.552   2.371   0.000  0.00  0.00           O+0
HETATM    7  N   UNK     0       1.886   0.061   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0       3.219   0.831   0.000  0.00  0.00           C+0
HETATM    9  B   UNK     0       4.553   0.061   0.000  0.00  0.00           B+0
HETATM   10  O   UNK     0       5.887   0.831   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0       4.553  -1.479   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      -2.115   0.831   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -3.522   0.205   0.000  0.00  0.00           C+0
HETATM   14  S   UNK     0      -4.553   1.349   0.000  0.00  0.00           S+0
HETATM   15  C   UNK     0      -3.783   2.683   0.000  0.00  0.00           C+0
HETATM   16  N   UNK     0      -4.409   4.090   0.000  0.00  0.00           N+0
HETATM   17  N   UNK     0      -2.276   2.363   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   12                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9                                                            
CONECT   12    4   13   17                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   12   15                                                       
MASTER        0    0    0    0    0    0    0    0   17    0   34    0
END