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	hartrees
Energy at 0K	-82.607386
Energy at 298.15K	-82.607216
HF Energy	-82.316557
Nuclear repulsion energy	7.539560

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.459
Li2	0.000	0.000	-1.225

	O1	Li2
O1		1.6841
Li2	1.6841

All results from a given calculation for LiO (lithium oxide)

using model chemistry: CCSD(T)=FULL/cc-pVQZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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