HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Thiamine.mol                                      
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  N   UNK     0       3.080   1.334   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0       3.850   0.000   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0       3.080  -1.334   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0       1.540  -1.334   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.770   0.000   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0      -0.770   0.000   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0      -1.540   1.334   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.770   2.667   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0       0.770   2.667   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0       1.540   1.334   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       0.770  -2.667   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      -3.080   1.334   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -3.850   0.000   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -3.080  -1.334   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -1.540  -1.334   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -5.390   0.000   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0      -3.850   2.667   0.000  0.00  0.00           O+0
HETATM   18  N   UNK     0       5.390   0.000   0.000  0.00  0.00           N+0
CONECT    1    2   10                                                       
CONECT    2    1    3   18                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   11                                                  
CONECT    5    4    6   10                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   12                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9    1    5                                                  
CONECT   11    4                                                            
CONECT   12   13   17    7                                                  
CONECT   13   12   14   16                                                  
CONECT   14   13   15                                                       
CONECT   15   14                                                            
CONECT   16   13                                                            
CONECT   17   12                                                            
CONECT   18    2                                                            
MASTER        0    0    0    0    0    0    0    0   18    0   38    0
END