Accuracy
rep739sys002g14pt100ab
179 rep739sys002g14pt100ab
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Geometry from http://www.nciatlas.org/
CHARGE=0
rep739sys002g14pt100ab
H=1.905+rep739sys002g14pt100a+rep739sys002g14pt100b HR=NCIA HWT=10
C -1.70000000 +0 0.00000000 +0 0.00000000 +0
H -2.78776514 +1 0.00000000 +0 0.00000000 +0
H -1.33764972 +0 1.02618677 +1 0.00000000 +0
H -1.33676902 +0 -0.51227405 +0 0.88724718 +0
H -1.33735462 +0 -0.51197956 +0 -0.88867894 +0
H 0.54824234 +0 -0.00018555 +0 0.00013743 +0
H 1.28981425 +0 -0.00043654 +0 0.00032332 +0