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	hartrees
Energy at 0K	-560.152261
Energy at 298.15K	-560.152660
HF Energy	-560.152261
Nuclear repulsion energy	37.115166

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.487
S2	0.000	0.000	1.022

	Na1	S2
Na1		2.5094
S2	2.5094

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	0.447
2	S	-0.447

	x	y	z	Total
	0.000	0.000	-7.743	7.743
CHELPG
AIM
ESP

All results from a given calculation for NaS (Sodium sulfide)

using model chemistry: PBEPBE/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>	52.501
(<r²>)^1/2	7.246