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	hartrees
Energy at 0K	-404.595504
Energy at 298.15K	-404.595446
HF Energy	-404.595504
Nuclear repulsion energy	11.923448

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.794
S2	0.000	0.000	0.336

	Li1	S2
Li1		2.1303
S2	2.1303

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Li	0.322
2	S	-0.322

	x	y	z	Total
	0.000	0.000	-6.587	6.587
CHELPG
AIM
ESP

All results from a given calculation for LiS (Lithium monosulfide)

using model chemistry: LSDA/cc-pCVTZ

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>	19.574
(<r²>)^1/2	4.424