HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 3a,7a-Dihydroxy-cholanoic acid.mol                
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0      -4.581  -4.742   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -4.581  -3.202   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -3.247  -2.432   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -3.247  -5.512   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -1.913  -4.742   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -0.580  -5.512   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.754  -4.742   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.754  -3.202   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.088  -2.432   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.552  -2.908   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.458  -1.662   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.552  -0.416   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.028   1.049   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.939   2.138   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.338   3.625   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.825   4.024   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       5.535   1.369   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.088  -0.892   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       2.088   0.648   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       0.754  -0.122   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -0.580  -0.892   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -0.580  -2.432   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -1.913  -3.202   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -1.913  -1.662   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       5.224   5.512   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       5.914   2.935   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0       2.088  -5.512   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      -5.914  -5.512   0.000  0.00  0.00           O+0
HETATM   29  H   UNK     0      -0.580  -3.972   0.000  0.00  0.00           H+0
HETATM   30  H   UNK     0       0.754  -1.662   0.000  0.00  0.00           H+0
HETATM   31  H   UNK     0       2.088  -3.972   0.000  0.00  0.00           H+0
CONECT    1    2    4   28                                                  
CONECT    2    1    3                                                       
CONECT    3    2   23                                                       
CONECT    4    1    5                                                       
CONECT    5    4    6   23                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   27                                                  
CONECT    8    7    9   22   30                                             
CONECT    9    8   10   18   31                                             
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   18                                                  
CONECT   13   12   14   17                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   25   26                                                  
CONECT   17   13                                                            
CONECT   18   12    9   19   20                                             
CONECT   19   18                                                            
CONECT   20   18   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21    8   23   29                                             
CONECT   23   22    3    5   24                                             
CONECT   24   23                                                            
CONECT   25   16                                                            
CONECT   26   16                                                            
CONECT   27    7                                                            
CONECT   28    1                                                            
CONECT   29   22                                                            
CONECT   30    8                                                            
CONECT   31    9                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   68    0
END