HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: AL9                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       1.783   5.326   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -0.171  -0.942   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.076  -2.188   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -0.450  -3.595   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -1.355  -4.841   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -2.886  -4.680   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -3.513  -3.273   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -2.608  -2.027   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       1.783   8.406   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0       0.243   6.866   0.000  0.00  0.00           O+0
HETATM   11  N   UNK     0       3.323   6.866   0.000  0.00  0.00           N+0
HETATM   12  S   UNK     0       1.783   6.866   0.000  0.00  0.00           S+0
HETATM   13  C   UNK     0       3.029   4.421   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.553   2.956   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.013   2.956   0.000  0.00  0.00           C+0
HETATM   16  S   UNK     0       0.537   4.421   0.000  0.00  0.00           S+0
HETATM   17  S   UNK     0       0.108   1.710   0.000  0.00  0.00           S+0
HETATM   18  O   UNK     0      -1.138   2.616   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       1.354   0.805   0.000  0.00  0.00           O+0
HETATM   20  N   UNK     0      -0.797   0.465   0.000  0.00  0.00           N+0
HETATM   21  O   UNK     0      -3.792  -5.926   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      -3.165  -7.333   0.000  0.00  0.00           C+0
CONECT    1   12   13   16                                                  
CONECT    2    3   20                                                       
CONECT    3    2    4    8                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7   21                                                  
CONECT    7    6    8                                                       
CONECT    8    3    7                                                       
CONECT    9   12                                                            
CONECT   10   12                                                            
CONECT   11   12                                                            
CONECT   12    1    9   10   11                                             
CONECT   13    1   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16    1   15                                                       
CONECT   17   15   18   19   20                                             
CONECT   18   17                                                            
CONECT   19   17                                                            
CONECT   20    2   17                                                       
CONECT   21    6   22                                                       
CONECT   22   21                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   46    0
END