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	hartrees
Energy at 0K	-362.386358
Energy at 298.15K	-362.386658
HF Energy	-362.386358
Nuclear repulsion energy	20.169530

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.807
Mg2	0.000	0.000	1.656

	Na1	Mg2
Na1		3.4632
Mg2	3.4632

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	-0.064
2	Mg	0.064

	x	y	z	Total
	0.000	0.000	-0.673	0.673
CHELPG
AIM
ESP

All results from a given calculation for NaMg (Sodium Magnesium)

using model chemistry: B3LYP/aug-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>	83.664
(<r²>)^1/2	9.147