HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: TQD                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -7.069  -2.120   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -5.735   0.190   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -4.402  -0.580   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -3.068   0.190   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -1.734  -0.580   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -1.734  -2.120   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -3.068  -2.890   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -4.402  -2.120   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -0.401   0.190   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.267   0.190   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.267   1.730   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.600   2.500   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.934   4.810   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.934   1.730   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.601   1.730   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.934   0.190   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.268  -2.120   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       3.600  -0.580   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0      -5.735  -2.890   0.000  0.00  0.00           N+0
HETATM   20  N   UNK     0      -8.403  -2.890   0.000  0.00  0.00           N+0
HETATM   21  N   UNK     0      -7.069  -0.580   0.000  0.00  0.00           N+0
HETATM   22  N   UNK     0      -5.735   1.730   0.000  0.00  0.00           N+0
HETATM   23  N   UNK     0       0.933  -0.580   0.000  0.00  0.00           N+0
HETATM   24  O   UNK     0       3.600   4.040   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       6.268   2.500   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       6.268  -0.580   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       0.933  -2.120   0.000  0.00  0.00           C+0
HETATM   28  H   UNK     0      -7.069  -3.210   0.000  0.00  0.00           H+0
HETATM   29  H   UNK     0      -1.734   0.510   0.000  0.00  0.00           H+0
CONECT    1   19   20   21   28                                             
CONECT    2    3   21   22                                                  
CONECT    3    2    4    8                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6    9   29                                             
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    3    7   19                                                  
CONECT    9    5   23                                                       
CONECT   10   11   18   23                                                  
CONECT   11   10   12                                                       
CONECT   12   11   14   24                                                  
CONECT   13   24                                                            
CONECT   14   12   16   25                                                  
CONECT   15   25                                                            
CONECT   16   14   18   26                                                  
CONECT   17   26                                                            
CONECT   18   10   16                                                       
CONECT   19    1    8                                                       
CONECT   20    1                                                            
CONECT   21    1    2                                                       
CONECT   22    2                                                            
CONECT   23    9   10   27                                                  
CONECT   24   12   13                                                       
CONECT   25   14   15                                                       
CONECT   26   16   17                                                       
CONECT   27   23                                                            
CONECT   28    1                                                            
CONECT   29    5                                                            
MASTER        0    0    0    0    0    0    0    0   29    0   62    0
END