HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 1CN                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  S   UNK     0       3.155   3.604   0.000  0.00  0.00           S+0
HETATM    2  O   UNK     0       3.155   5.144   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0       1.615   3.604   0.000  0.00  0.00           O+0
HETATM    4  N   UNK     0       4.695   3.604   0.000  0.00  0.00           N+0
HETATM    5  N   UNK     0       4.400   1.159   0.000  0.00  0.00           N+0
HETATM    6  N   UNK     0       3.925  -0.306   0.000  0.00  0.00           N+0
HETATM    7  S   UNK     0       1.909   1.159   0.000  0.00  0.00           S+0
HETATM    8  C   UNK     0       3.155   2.064   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.385  -0.306   0.000  0.00  0.00           C+0
HETATM   10  N   UNK     0       1.479  -1.552   0.000  0.00  0.00           N+0
HETATM   11  S   UNK     0      -0.052  -1.391   0.000  0.00  0.00           S+0
HETATM   12  O   UNK     0       0.109   0.141   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0      -0.213  -2.922   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0      -2.489  -2.476   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -2.210   0.177   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -4.020  -2.315   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -4.647  -0.908   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -3.742   0.338   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -1.584  -1.230   0.000  0.00  0.00           C+0
HETATM   20  F   UNK     0      -4.926  -3.560   0.000  0.00  0.00           F+0
HETATM   21 Cl   UNK     0      -4.368   1.745   0.000  0.00  0.00          Cl+0
HETATM   22  N   UNK     0      -6.178  -0.747   0.000  0.00  0.00           N+0
CONECT    1    2    3    4    8                                             
CONECT    2    1                                                            
CONECT    3    1                                                            
CONECT    4    1                                                            
CONECT    5    6    8                                                       
CONECT    6    5    9                                                       
CONECT    7    8    9                                                       
CONECT    8    1    5    7                                                  
CONECT    9    6    7   10                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   13   19                                             
CONECT   12   11                                                            
CONECT   13   11                                                            
CONECT   14   16   19                                                       
CONECT   15   18   19                                                       
CONECT   16   14   17   20                                                  
CONECT   17   16   18   22                                                  
CONECT   18   15   17   21                                                  
CONECT   19   11   14   15                                                  
CONECT   20   16                                                            
CONECT   21   18                                                            
CONECT   22   17                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   46    0
END