HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: IX1                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       4.701  -3.156   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.367  -3.926   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.034  -3.156   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.034  -1.616   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       3.367  -0.846   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.701  -1.616   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.367  -5.466   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       4.613  -6.371   0.000  0.00  0.00           O+0
HETATM    9  N   UNK     0       4.137  -7.835   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0       2.597  -7.835   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.121  -6.371   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.692  -9.081   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       2.318 -10.488   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0       0.160  -8.920   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       0.700  -0.846   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.967   3.774   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -3.301   3.004   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -4.635   3.774   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -4.635   5.314   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -3.301   6.084   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -1.967   5.314   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -0.634   6.084   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       0.700   5.314   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      -0.634   7.624   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      -1.967   8.394   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -3.301   7.624   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      -0.634   3.004   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0      -0.634   1.464   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       0.700   0.694   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       0.657  -5.895   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      -0.488  -6.925   0.000  0.00  0.00           O+0
CONECT    1    2    6                                                       
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   15                                                  
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    2    8   11                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11    7   10   30                                                  
CONECT   12   10   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12                                                            
CONECT   15    4   29                                                       
CONECT   16   17   21   27                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   26                                                  
CONECT   21   16   20   22                                                  
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25                                                       
CONECT   25   24                                                            
CONECT   26   20                                                            
CONECT   27   16   28                                                       
CONECT   28   27   29                                                       
CONECT   29   15   28                                                       
CONECT   30   11   31                                                       
CONECT   31   30                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   66    0
END