HEADER    PROTEIN                                 15-MAY-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 12589                                             
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   15-MAY-12         0                                  
HETATM    1  O   UNK     0       3.080   1.155   0.000  0.00  0.00           O-1
HETATM    2  O   UNK     0       4.414  -1.155   0.000  0.00  0.00           O+0
HETATM    3  N   UNK     0       4.414   0.385   0.000  0.00  0.00           N+1
HETATM    4  C   UNK     0       8.415   1.155   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       9.749   0.385   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.081   0.385   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      11.082   1.155   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.747   1.155   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      12.416   0.385   0.000  0.00  0.00           C+0
HETATM   10  H   UNK     0       9.029   1.887   0.000  0.00  0.00           H+0
HETATM   11  H   UNK     0       7.801   1.887   0.000  0.00  0.00           H+0
HETATM   12  H   UNK     0       9.135  -0.346   0.000  0.00  0.00           H+0
HETATM   13  H   UNK     0      10.362  -0.346   0.000  0.00  0.00           H+0
HETATM   14  H   UNK     0       6.468  -0.346   0.000  0.00  0.00           H+0
HETATM   15  H   UNK     0       7.695  -0.346   0.000  0.00  0.00           H+0
HETATM   16  H   UNK     0      11.696   1.887   0.000  0.00  0.00           H+0
HETATM   17  H   UNK     0      10.469   1.887   0.000  0.00  0.00           H+0
HETATM   18  H   UNK     0       6.361   1.887   0.000  0.00  0.00           H+0
HETATM   19  H   UNK     0       5.134   1.887   0.000  0.00  0.00           H+0
HETATM   20  H   UNK     0      11.939  -0.442   0.000  0.00  0.00           H+0
HETATM   21  H   UNK     0      13.243  -0.092   0.000  0.00  0.00           H+0
HETATM   22  H   UNK     0      12.893   1.212   0.000  0.00  0.00           H+0
CONECT    1    3                                                            
CONECT    2    3                                                            
CONECT    3    1    2    8                                                  
CONECT    4    5    6   10   11                                             
CONECT    5    4    7   12   13                                             
CONECT    6    4    8   14   15                                             
CONECT    7    5    9   16   17                                             
CONECT    8    3    6   18   19                                             
CONECT    9    7   20   21   22                                             
CONECT   10    4                                                            
CONECT   11    4                                                            
CONECT   12    5                                                            
CONECT   13    5                                                            
CONECT   14    6                                                            
CONECT   15    6                                                            
CONECT   16    7                                                            
CONECT   17    7                                                            
CONECT   18    8                                                            
CONECT   19    8                                                            
CONECT   20    9                                                            
CONECT   21    9                                                            
CONECT   22    9                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   42    0
END