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	hartrees
Energy at 0K	-82.429493
Energy at 298.15K	-82.429331
HF Energy	-82.274501
Nuclear repulsion energy	7.416904

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.459
Li2	0.000	0.000	-1.224

	O1	Li2
O1		1.6825
Li2	1.6825

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

using model chemistry: CID/6-31G*

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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