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	hartrees
Energy at 0K	-107.387967
Energy at 298.15K
HF Energy	-107.387967
Nuclear repulsion energy	9.137931

Atom	x (Å)	y (Å)	z (Å)
F1	0.000	0.000	0.391
Li2	0.000	0.000	-1.173

	F1	Li2
F1		1.5636
Li2	1.5636

Number	Element	Mulliken	CHELPG	AIM	ESP
1	F	-0.561
2	Li	0.561

	x	y	z	Total
	0.000	0.000	-5.825	5.825
CHELPG
AIM
ESP

All results from a given calculation for LiF (lithium fluoride)

using model chemistry: wB97X-D/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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<r²>	8.796
(<r²>)^1/2	2.966