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	hartrees
Energy at 0K	-206.323541
Energy at 298.15K	-206.323326
HF Energy	-206.323541
Nuclear repulsion energy	6.214518

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-2.452
Mg2	0.000	0.000	0.613

	Li1	Mg2
Li1		3.0655
Mg2	3.0655

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Li	0.174
2	Mg	-0.174

	x	y	z	Total
	0.000	0.000	-1.059	1.059
CHELPG
AIM
ESP

All results from a given calculation for LiMg (Lithium magnesium)

using model chemistry: B3PW91/3-21G

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>	34.947
(<r²>)^1/2	5.912