HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 701                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1 Cl   UNK     0       2.440   6.406   0.000  0.00  0.00          Cl+0
HETATM    2  C   UNK     0       2.440   4.866   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.686   3.961   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       3.210   2.496   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       1.670   2.496   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.765   1.250   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.391  -0.156   0.000  0.00  0.00           C+0
HETATM    8  S   UNK     0      -1.672   0.166   0.000  0.00  0.00           S+0
HETATM    9  O   UNK     0      -2.918   1.071   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0      -0.426  -0.740   0.000  0.00  0.00           O+0
HETATM   11  N   UNK     0      -2.577  -1.080   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0      -1.951  -2.487   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -0.445  -2.807   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.284  -4.339   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -2.721  -3.821   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -4.252  -3.982   0.000  0.00  0.00           O+0
HETATM   17  N   UNK     0      -1.690  -4.965   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0      -2.011  -6.472   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -3.475  -6.948   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.866  -7.502   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       0.598  -7.026   0.000  0.00  0.00           O+0
HETATM   22  N   UNK     0      -1.186  -9.008   0.000  0.00  0.00           N+0
HETATM   23  C   UNK     0      -0.042 -10.039   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -0.362 -11.545   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      -1.827 -12.021   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0      -2.971 -10.991   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -2.651  -9.484   0.000  0.00  0.00           C+0
HETATM   28  S   UNK     0       1.194   3.961   0.000  0.00  0.00           S+0
HETATM   29  C   UNK     0      -0.767   1.411   0.000  0.00  0.00           C+0
HETATM   30  H   UNK     0      -1.265  -1.640   0.000  0.00  0.00           H+0
HETATM   31  H   UNK     0      -2.821  -5.742   0.000  0.00  0.00           H+0
CONECT    1    2                                                            
CONECT    2    1    3   28                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   28                                                  
CONECT    6    5    7   29                                                  
CONECT    7    6                                                            
CONECT    8    9   10   11   29                                             
CONECT    9    8                                                            
CONECT   10    8                                                            
CONECT   11    8   12                                                       
CONECT   12   11   13   15   30                                             
CONECT   13   12   14                                                       
CONECT   14   13   17                                                       
CONECT   15   12   16   17                                                  
CONECT   16   15                                                            
CONECT   17   14   15   18                                                  
CONECT   18   17   19   20   31                                             
CONECT   19   18                                                            
CONECT   20   18   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   23   27                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   22   26                                                       
CONECT   28    2    5                                                       
CONECT   29    6    8                                                       
CONECT   30   12                                                            
CONECT   31   18                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   66    0
END