HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: CIN                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       0.310   0.390   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       0.310  -1.150   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.023  -1.920   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.357  -1.150   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -2.357   0.390   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -1.023   1.160   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.644   1.160   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.978   0.390   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       4.311   1.160   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -3.691  -1.920   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       5.645   0.390   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0       4.311   2.700   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0      -3.691  -3.460   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0      -5.024  -1.150   0.000  0.00  0.00           O+0
CONECT    1    2    6    7                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   10                                                  
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    1    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   11   12                                                  
CONECT   10    4   13   14                                                  
CONECT   11    9                                                            
CONECT   12    9                                                            
CONECT   13   10                                                            
CONECT   14   10                                                            
MASTER        0    0    0    0    0    0    0    0   14    0   28    0
END