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	hartrees
Energy at 0K	-621.433796
Energy at 298.15K	-621.434308
HF Energy	-621.433796
Nuclear repulsion energy	41.268707

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.456
Cl2	0.000	0.000	0.942

	Na1	Cl2
Na1		2.3978
Cl2	2.3978

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	0.647
2	Cl	-0.647

	x	y	z	Total
	0.000	0.000	-9.475	9.475
CHELPG
AIM
ESP

All results from a given calculation for NaCl (Sodium Chloride)

using model chemistry: HF/cc-pVDZ

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>	48.552
(<r²>)^1/2	6.968