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	hartrees
Energy at 0K	-15.492249
Energy at 298.15K	-15.490870
HF Energy	-15.492249
Nuclear repulsion energy	1.332833

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-2.382
Mg2	0.000	0.000	0.794

	Be1	Mg2
Be1		3.1763
Mg2	3.1763

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Be	-0.089
2	Mg	0.089

	x	y	z	Total
	0.000	0.000	0.441	0.441
CHELPG
AIM
ESP

All results from a given calculation for BeMg (Beryllium Magnesium)

using model chemistry: B3LYP/LANL2DZ

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>	35.934
(<r²>)^1/2	5.995