sim/src/tests/heteroatom_organics/C4H8SiH2.pdb


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COMPND    C4H8SiH2.inp.log 
AUTHOR    GENERATED BY OPEN BABEL 2.0.0rc1
HETATM    1 SI   LIG     1       0.718   0.746  -0.067  1.00  0.00          SI  
HETATM    2  C   LIG     1       0.225  -0.428   1.360  1.00  0.00           C  
HETATM    3  C   LIG     1      -0.541   0.051  -1.324  1.00  0.00           C  
HETATM    4  C   LIG     1      -1.089  -1.080   0.857  1.00  0.00           C  
HETATM    5  C   LIG     1      -0.998  -1.278  -0.669  1.00  0.00           C  
HETATM    6  H   LIG     1       2.140   0.581  -0.490  1.00  0.00           H  
HETATM    7  H   LIG     1       0.505   2.191   0.241  1.00  0.00           H  
HETATM    8  H   LIG     1       0.099   0.069   2.327  1.00  0.00           H  
HETATM    9  H   LIG     1       1.004  -1.189   1.489  1.00  0.00           H  
HETATM   10  H   LIG     1      -0.145  -0.096  -2.333  1.00  0.00           H  
HETATM   11  H   LIG     1      -1.390   0.740  -1.407  1.00  0.00           H  
HETATM   12  H   LIG     1      -1.291  -2.028   1.371  1.00  0.00           H  
HETATM   13  H   LIG     1      -1.933  -0.415   1.084  1.00  0.00           H  
HETATM   14  H   LIG     1      -0.256  -2.061  -0.885  1.00  0.00           H  
HETATM   15  H   LIG     1      -1.951  -1.634  -1.079  1.00  0.00           H  
CONECT    1    3    6    7    2                                       
CONECT    2    1    4    9    8                                       
CONECT    3   10   11    5    1                                       
CONECT    4    5   13    2   12                                       
CONECT    5    3   15   14    4                                       
CONECT    6    1                                                      
CONECT    7    1                                                      
CONECT    8    2                                                      
CONECT    9    2                                                      
CONECT   10    3                                                      
CONECT   11    3                                                      
CONECT   12    4                                                      
CONECT   13    4                                                      
CONECT   14    5                                                      
CONECT   15    5                                                      
MASTER        0    0    0    0    0    0    0    0   15    0   15    0
END