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	hartrees
Energy at 0K	-8.042352
Energy at 298.15K	-8.042411
HF Energy	-8.042352
Nuclear repulsion energy	0.973277

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	0.408
H2	0.000	0.000	-1.223

	Li1	H2
Li1		1.6311
H2	1.6311

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Li	-0.046
2	H	0.046

	x	y	z	Total
	0.000	0.000	5.583	5.583
CHELPG
AIM
ESP

All results from a given calculation for LiH (Lithium Hydride)

using model chemistry: PBEPBE/6-31G(2df,p)

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>	5.872
(<r²>)^1/2	2.423