HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: SG1                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  S   UNK     0       4.891   1.365   0.000  0.00  0.00           S+0
HETATM    2  C   UNK     0       3.427   0.890   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.107  -0.617   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.642  -1.093   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.497  -0.062   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0      -0.967  -0.538   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0      -1.443  -2.003   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -0.538  -3.249   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -2.983  -2.003   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -3.459  -0.538   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -2.213   0.367   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.818   1.444   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0      -0.327   2.475   0.000  0.00  0.00           N+1
HETATM   14  O   UNK     0      -0.007   3.981   0.000  0.00  0.00           O-1
HETATM   15  O   UNK     0      -1.791   1.999   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       2.282   1.920   0.000  0.00  0.00           C+0
HETATM   17  N   UNK     0       6.356   1.841   0.000  0.00  0.00           N+0
HETATM   18  O   UNK     0       5.367  -0.099   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       4.415   2.830   0.000  0.00  0.00           O+0
CONECT    1    2   17   18   19                                             
CONECT    2    1    3   16                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   12                                                  
CONECT    6    5    7   11                                                  
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11                                                       
CONECT   11    6   10                                                       
CONECT   12    5   13   16                                                  
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13                                                            
CONECT   16    2   12                                                       
CONECT   17    1                                                            
CONECT   18    1                                                            
CONECT   19    1                                                            
MASTER        0    0    0    0    0    0    0    0   19    0   40    0
END