HEADER    PROTEIN                                 09-JAN-13   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 4-O-a-D-Glucopyranosylmoranoline, CAS:80312-32-9  
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   09-JAN-13         0                                  
HETATM    1  C   UNK     0       1.314  -1.168   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.314   0.350   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      -0.022  -1.934   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0       2.654  -1.934   0.000  0.00  0.00           C+0
HETATM    5  N   UNK     0       2.654   1.112   0.000  0.00  0.00           N+0
HETATM    6  C   UNK     0      -0.057   1.081   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.340  -1.168   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       3.990  -1.168   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       2.654  -3.505   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       3.990   0.350   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      -0.043   2.565   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      -1.327   0.372   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      -2.698  -1.921   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       5.330  -1.977   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      -2.632   1.168   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -3.990  -1.112   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      -2.732  -3.440   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      -3.990   0.429   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.619   2.695   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      -5.330  -1.864   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -5.295   1.238   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -3.911   3.505   0.000  0.00  0.00           O+0
CONECT    1    2    3    4                                                  
CONECT    2    1    5    6                                                  
CONECT    3    1    7                                                       
CONECT    4    1    8    9                                                  
CONECT    5    2   10                                                       
CONECT    6    2   11                                                       
CONECT    7    3   12   13                                                  
CONECT    8    4   14   10                                                  
CONECT    9    4                                                            
CONECT   10    5    8                                                       
CONECT   11    6                                                            
CONECT   12    7   15                                                       
CONECT   13    7   16   17                                                  
CONECT   14    8                                                            
CONECT   15   12   18   19                                                  
CONECT   16   13   20   18                                                  
CONECT   17   13                                                            
CONECT   18   15   16   21                                                  
CONECT   19   15   22                                                       
CONECT   20   16                                                            
CONECT   21   18                                                            
CONECT   22   19                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   46    0
END