HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: AON                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0      -2.813   1.202   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -1.821   0.024   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       0.219   1.744   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.735   2.015   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.727   0.837   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       2.204  -0.611   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.420  -1.556   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.694  -0.692   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       4.266   0.787   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.399   2.223   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.298   1.473   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -4.329   0.930   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -4.853  -0.518   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -3.860  -1.695   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -2.344  -1.424   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.351  -2.602   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       0.165  -2.331   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       0.688  -0.882   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -0.305   0.295   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      -6.369  -0.789   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0       5.212   2.003   0.000  0.00  0.00           O+0
HETATM   22  H   UNK     0       1.943  -1.669   0.000  0.00  0.00           H+0
HETATM   23  H   UNK     0       3.803   1.774   0.000  0.00  0.00           H+0
HETATM   24  H   UNK     0      -5.555   0.315   0.000  0.00  0.00           H+0
HETATM   25  H   UNK     0      -2.714  -2.449   0.000  0.00  0.00           H+0
HETATM   26  H   UNK     0       1.391  -1.715   0.000  0.00  0.00           H+0
HETATM   27  H   UNK     0      -1.007   1.129   0.000  0.00  0.00           H+0
CONECT    1    2   12                                                       
CONECT    2    1   11   15   19                                             
CONECT    3    4   19                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    9   10                                             
CONECT    6    5    7   18   22                                             
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    5    8   21   23                                             
CONECT   10    5                                                            
CONECT   11    2                                                            
CONECT   12    1   13                                                       
CONECT   13   12   14   20   24                                             
CONECT   14   13   15                                                       
CONECT   15    2   14   16   25                                             
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18    6   17   19   26                                             
CONECT   19    2    3   18   27                                             
CONECT   20   13                                                            
CONECT   21    9                                                            
CONECT   22    6                                                            
CONECT   23    9                                                            
CONECT   24   13                                                            
CONECT   25   15                                                            
CONECT   26   18                                                            
CONECT   27   19                                                            
MASTER        0    0    0    0    0    0    0    0   27    0   60    0
END