HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: EQI                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       5.073   0.594   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       4.080   1.771   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.564   1.500   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.041   0.052   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       3.034  -1.126   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.550  -0.854   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.571   2.678   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.055   2.407   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -0.468   0.958   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       0.525  -0.219   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.984   0.687   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -2.507  -0.761   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -1.514  -1.939   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       0.002  -1.668   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -3.200   1.632   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -4.474   0.768   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -4.046  -0.711   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -3.179  -2.147   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       6.589   0.865   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      -4.991  -1.927   0.000  0.00  0.00           O+0
HETATM   21  H   UNK     0       1.228  -1.053   0.000  0.00  0.00           H+0
HETATM   22  H   UNK     0      -1.723   1.745   0.000  0.00  0.00           H+0
CONECT    1    2    6   19                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4    7                                                  
CONECT    4    3    5   10                                                  
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    3    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    4    9   14   21                                             
CONECT   11    9   12   15   22                                             
CONECT   12   11   13   17   18                                             
CONECT   13   12   14                                                       
CONECT   14   10   13                                                       
CONECT   15   11   16                                                       
CONECT   16   15   17                                                       
CONECT   17   12   16   20                                                  
CONECT   18   12                                                            
CONECT   19    1                                                            
CONECT   20   17                                                            
CONECT   21   10                                                            
CONECT   22   11                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   50    0
END