HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 863                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  S   UNK     0      12.373  -1.093   0.000  0.00  0.00           S+0
HETATM    2  O   UNK     0      16.228  -2.553   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0       3.080   0.095   0.000  0.00  0.00           O-1
HETATM    4  O   UNK     0       4.865   2.077   0.000  0.00  0.00           O+0
HETATM    5  N   UNK     0      20.083  -1.093   0.000  0.00  0.00           N+0
HETATM    6  N   UNK     0       8.299  -1.015   0.000  0.00  0.00           N+0
HETATM    7  N   UNK     0       7.474   1.522   0.000  0.00  0.00           N+0
HETATM    8  N   UNK     0       4.545   0.571   0.000  0.00  0.00           N+1
HETATM    9  C   UNK     0      18.938  -2.124   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      17.474  -1.648   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      14.982  -1.648   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      13.517  -2.124   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      16.998  -0.183   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      15.458  -0.183   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      10.908  -1.569   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       9.763  -0.539   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      19.763   0.413   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      21.548  -1.569   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.154   0.016   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       5.689  -0.460   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       6.330   2.553   0.000  0.00  0.00           C+0
CONECT    1   12   15                                                       
CONECT    2   10   11                                                       
CONECT    3    8                                                            
CONECT    4    8                                                            
CONECT    5    9   17   18                                                  
CONECT    6   16   19                                                       
CONECT    7   19   21                                                       
CONECT    8    3    4   20                                                  
CONECT    9    5   10                                                       
CONECT   10    2    9   13                                                  
CONECT   11    2   12   14                                                  
CONECT   12    1   11                                                       
CONECT   13   10   14                                                       
CONECT   14   11   13                                                       
CONECT   15    1   16                                                       
CONECT   16    6   15                                                       
CONECT   17    5                                                            
CONECT   18    5                                                            
CONECT   19    6    7   20                                                  
CONECT   20    8   19                                                       
CONECT   21    7                                                            
MASTER        0    0    0    0    0    0    0    0   21    0   42    0
END