sim/src/tests/heteroatom_organics/C_CH3_3_SiH3.pdb


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COMPND    C_CH3_3_SiH3.inp.log 
AUTHOR    GENERATED BY OPEN BABEL 2.0.0rc1
HETATM    1  C   LIG     1       0.000   0.000  -0.172  1.00  0.00           C  
HETATM    2  C   LIG     1       0.727  -1.259  -0.687  1.00  0.00           C  
HETATM    3  C   LIG     1       0.727   1.259  -0.687  1.00  0.00           C  
HETATM    4  C   LIG     1      -1.453   0.000  -0.687  1.00  0.00           C  
HETATM    5 SI   LIG     1       0.000   0.000   1.740  1.00  0.00          SI  
HETATM    6  H   LIG     1       1.771  -1.297  -0.356  1.00  0.00           H  
HETATM    7  H   LIG     1       0.238   2.183  -0.356  1.00  0.00           H  
HETATM    8  H   LIG     1      -2.009   0.885  -0.356  1.00  0.00           H  
HETATM    9  H   LIG     1       0.238  -2.183  -0.356  1.00  0.00           H  
HETATM   10  H   LIG     1       1.771   1.297  -0.356  1.00  0.00           H  
HETATM   11  H   LIG     1      -2.009  -0.885  -0.356  1.00  0.00           H  
HETATM   12  H   LIG     1       0.735  -1.273  -1.786  1.00  0.00           H  
HETATM   13  H   LIG     1       0.735   1.273  -1.786  1.00  0.00           H  
HETATM   14  H   LIG     1      -1.470   0.000  -1.786  1.00  0.00           H  
HETATM   15  H   LIG     1      -0.697   1.208   2.272  1.00  0.00           H  
HETATM   16  H   LIG     1      -0.697  -1.208   2.272  1.00  0.00           H  
HETATM   17  H   LIG     1       1.395   0.000   2.272  1.00  0.00           H  
CONECT    1    2    3    4    5                                       
CONECT    2   12    6    9    1                                       
CONECT    3   13    7   10    1                                       
CONECT    4   14    8   11    1                                       
CONECT    5    1   15   16   17                                       
CONECT    6    2                                                      
CONECT    7    3                                                      
CONECT    8    4                                                      
CONECT    9    2                                                      
CONECT   10    3                                                      
CONECT   11    4                                                      
CONECT   12    2                                                      
CONECT   13    3                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
MASTER        0    0    0    0    0    0    0    0   17    0   17    0
END