HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 462                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -4.595   7.415   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -3.131   6.939   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -2.811   5.433   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      -1.346   4.957   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      -1.026   3.450   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.439   2.975   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.759   1.468   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.385   0.438   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.850   0.914   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.170   2.420   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.065  -1.069   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.096  -2.213   0.000  0.00  0.00           C+0
HETATM   13  S   UNK     0      -0.326  -3.547   0.000  0.00  0.00           S+0
HETATM   14  C   UNK     0       1.181  -3.227   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.342  -1.695   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.675  -0.925   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       2.675   0.615   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       1.342   1.385   0.000  0.00  0.00           O+0
HETATM   19  N   UNK     0       4.009   1.385   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       5.343   0.615   0.000  0.00  0.00           C+0
HETATM   21  N   UNK     0       5.343  -0.925   0.000  0.00  0.00           N+0
HETATM   22  N   UNK     0       6.676   1.385   0.000  0.00  0.00           N+0
HETATM   23  C   UNK     0       2.325  -4.257   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       3.790  -3.781   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.934  -4.812   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       4.614  -6.318   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       3.149  -6.794   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       2.005  -5.764   0.000  0.00  0.00           C+0
HETATM   29 Cl   UNK     0       0.540  -6.239   0.000  0.00  0.00          Cl+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   10                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7   11    9                                                  
CONECT    9    8   10                                                       
CONECT   10    5    9                                                       
CONECT   11    8   12   15                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   23                                                  
CONECT   15   11   14   16                                                  
CONECT   16   17   15                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   20   17                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20                                                            
CONECT   23   14   24   28                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   28   26                                                       
CONECT   28   27   23   29                                                  
CONECT   29   28                                                            
MASTER        0    0    0    0    0    0    0    0   29    0   62    0
END