HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: XMK                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       2.181   2.628   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -4.487   8.018   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0      -1.820   4.938   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0      -3.153   5.708   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -3.153   7.248   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -0.486   5.708   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -4.487   4.938   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.820   3.398   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.848   3.398   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       0.848   4.938   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0      -5.821   7.248   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0      -5.821   5.708   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -0.486   2.628   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       0.848  -5.842   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       2.181  -5.072   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -0.486  -8.152   0.000  0.00  0.00           C+0
HETATM   17  S   UNK     0       2.181  -3.532   0.000  0.00  0.00           S+0
HETATM   18  C   UNK     0       0.848  -7.382   0.000  0.00  0.00           C+0
HETATM   19 Cl   UNK     0       0.848 -12.002   0.000  0.00  0.00          Cl+0
HETATM   20  O   UNK     0       3.721  -3.532   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       3.515   0.318   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       3.515  -1.222   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0       2.181  -1.992   0.000  0.00  0.00           N+0
HETATM   24  C   UNK     0       2.181  -8.152   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.848   0.318   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.848  -1.222   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -0.486  -9.692   0.000  0.00  0.00           C+0
HETATM   28  N   UNK     0       2.181   1.088   0.000  0.00  0.00           N+0
HETATM   29  C   UNK     0       2.181  -9.692   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       0.848 -10.462   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       0.641  -3.532   0.000  0.00  0.00           O+0
CONECT    1    9   28                                                       
CONECT    2    5   11                                                       
CONECT    3    4    6    8                                                  
CONECT    4    3    5    7                                                  
CONECT    5    2    4                                                       
CONECT    6    3   10                                                       
CONECT    7    4   12                                                       
CONECT    8    3   13                                                       
CONECT    9    1   10   13                                                  
CONECT   10    6    9                                                       
CONECT   11    2   12                                                       
CONECT   12    7   11                                                       
CONECT   13    8    9                                                       
CONECT   14   15   18                                                       
CONECT   15   14   17                                                       
CONECT   16   18   27                                                       
CONECT   17   15   20   23   31                                             
CONECT   18   14   16   24                                                  
CONECT   19   30                                                            
CONECT   20   17                                                            
CONECT   21   22   28                                                       
CONECT   22   21   23                                                       
CONECT   23   17   22   26                                                  
CONECT   24   18   29                                                       
CONECT   25   26   28                                                       
CONECT   26   23   25                                                       
CONECT   27   16   30                                                       
CONECT   28    1   21   25                                                  
CONECT   29   24   30                                                       
CONECT   30   19   27   29                                                  
CONECT   31   17                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   68    0
END