HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: LGB                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -2.646  -0.411   0.000  0.00  0.00           C+0
HETATM    2  N   UNK     0      -1.182  -0.887   0.000  0.00  0.00           N+0
HETATM    3  C   UNK     0      -1.182  -2.427   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.646  -2.902   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -3.552  -1.657   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.283  -0.411   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       1.188  -1.657   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       0.283  -2.902   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0       0.759   1.054   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0       2.265   1.374   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.741   2.839   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.247   3.159   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       5.278   2.014   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.802   0.550   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.296   0.230   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.711   3.983   0.000  0.00  0.00           C+0
HETATM   17 Cl   UNK     0       4.723   4.624   0.000  0.00  0.00          Cl+0
HETATM   18  O   UNK     0      -3.122  -4.367   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       6.784   2.335   0.000  0.00  0.00           C+0
HETATM   20  N   UNK     0       8.290   2.655   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0       0.759  -4.367   0.000  0.00  0.00           C+0
HETATM   22  F   UNK     0       1.235  -5.832   0.000  0.00  0.00           F+0
HETATM   23  F   UNK     0      -0.706  -4.843   0.000  0.00  0.00           F+0
HETATM   24  F   UNK     0       2.223  -3.891   0.000  0.00  0.00           F+0
HETATM   25  H   UNK     0      -1.182  -3.517   0.000  0.00  0.00           H+0
HETATM   26  H   UNK     0      -1.876  -3.673   0.000  0.00  0.00           H+0
HETATM   27  H   UNK     0      -0.488  -3.673   0.000  0.00  0.00           H+0
CONECT    1    2    5                                                       
CONECT    2    1    3    6                                                  
CONECT    3    2    8   25    4                                             
CONECT    4    3   18   26    5                                             
CONECT    5    1    4                                                       
CONECT    6    2    7    9                                                  
CONECT    7    6    8                                                       
CONECT    8    3    7   21   27                                             
CONECT    9    6   10                                                       
CONECT   10    9   11   15                                                  
CONECT   11   10   16   12                                                  
CONECT   12   11   17   13                                                  
CONECT   13   12   14   19                                                  
CONECT   14   13   15                                                       
CONECT   15   14   10                                                       
CONECT   16   11                                                            
CONECT   17   12                                                            
CONECT   18    4                                                            
CONECT   19   13   20                                                       
CONECT   20   19                                                            
CONECT   21    8   22   24   23                                             
CONECT   22   21                                                            
CONECT   23   21                                                            
CONECT   24   21                                                            
CONECT   25    3                                                            
CONECT   26    4                                                            
CONECT   27    8                                                            
MASTER        0    0    0    0    0    0    0    0   27    0   58    0
END