HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: B98                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       4.421  -0.237   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.410  -1.399   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.408   1.513   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.398   0.352   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -0.142   0.325   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.920   1.219   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.898  -1.105   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.593  -1.147   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -2.026  -1.713   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.548   1.708   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -3.594   0.577   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       6.442   2.086   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -5.066   1.028   0.000  0.00  0.00           C+0
HETATM   14  N   UNK     0      -1.012   1.596   0.000  0.00  0.00           N+0
HETATM   15  N   UNK     0      -3.361  -0.946   0.000  0.00  0.00           N+0
HETATM   16  N   UNK     0      -6.193  -0.022   0.000  0.00  0.00           N+0
HETATM   17  O   UNK     0      -2.137  -3.249   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       4.931   2.381   0.000  0.00  0.00           O+0
HETATM   19  S   UNK     0       0.668  -2.031   0.000  0.00  0.00           S+0
HETATM   20  H   UNK     0      -3.878   1.629   0.000  0.00  0.00           H+0
CONECT    1    2    6                                                       
CONECT    2    1    7                                                       
CONECT    3    4    6                                                       
CONECT    4    3    5    7                                                  
CONECT    5    4    8   14                                                  
CONECT    6    1    3   18                                                  
CONECT    7    2    4   19                                                  
CONECT    8    5    9   19                                                  
CONECT    9    8   15   17                                                  
CONECT   10   11   14                                                       
CONECT   11   10   13   15   20                                             
CONECT   12   18                                                            
CONECT   13   11   16                                                       
CONECT   14    5   10                                                       
CONECT   15    9   11                                                       
CONECT   16   13                                                            
CONECT   17    9                                                            
CONECT   18    6   12                                                       
CONECT   19    7    8                                                       
CONECT   20   11                                                            
MASTER        0    0    0    0    0    0    0    0   20    0   44    0
END