HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: I3N                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       5.357  -1.570   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       4.024  -2.340   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       2.690  -1.570   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.356  -2.340   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.022  -1.570   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.022  -0.030   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.356   0.740   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.690  -0.030   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      -1.442   0.445   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      -2.347  -0.800   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.442  -2.046   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.918  -3.511   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -0.888  -4.655   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       0.619  -4.335   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0      -1.363  -6.120   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -3.887  -0.800   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -1.918   1.910   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -0.888   3.054   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -1.363   4.519   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.333   5.663   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       1.173   5.343   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       1.649   3.879   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       0.619   2.734   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    8                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6   11                                                  
CONECT    6    5    7    9                                                  
CONECT    7    6    8                                                       
CONECT    8    3    7                                                       
CONECT    9    6   10   17                                                  
CONECT   10    9   11   16                                                  
CONECT   11    5   10   12                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13                                                            
CONECT   16   10                                                            
CONECT   17    9   18                                                       
CONECT   18   17   19   23                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   18   22                                                       
MASTER        0    0    0    0    0    0    0    0   23    0   50    0
END