Accuracy
rep739sys010g05pt100ab
306 rep739sys010g05pt100ab
(Previous)
(Back)
(Next)
Geometry from http://www.nciatlas.org/
CHARGE=0
rep739sys010g05pt100ab
H=2.153+rep739sys010g05pt100a+rep739sys010g05pt100b HR=NCIA HWT=10
C 0.27832284 +0 -0.30312049 +0 -2.58374141 +0
H -0.09367716 +1 -1.18112049 +0 -3.11974141 +0
H 1.33932284 +0 -1.25712049 +1 -1.24474141 +0
H 1.11432284 +0 0.12587951 +0 -3.14274141 +0
H -0.51867716 +0 0.43487951 +0 -2.53774141 +0
O 0.63432284 +0 -0.60712049 +0 -1.24074141 +0
C -1.69917596 +0 0.14519856 +0 1.48880965 +0
C -1.94088632 +0 0.88719568 +0 2.59575878 +0
C -0.79794746 +0 1.73446022 +0 2.76545430 +0
C 0.04448624 +0 1.43816706 +0 1.74732768 +0
H 1.01202894 +0 1.80478253 +0 1.45693444 +0
H -0.63347526 +0 2.46121127 +0 3.54095466 +0
H -2.25358233 +0 -0.61563769 +0 0.97179632 +0
H -2.81812443 +0 0.84179346 +0 3.21598853 +0
O -0.48893605 +0 0.46796847 +0 0.95636348 +0