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	hartrees
Energy at 0K	-200.624257
Energy at 298.15K	-200.624454
HF Energy	-200.624257
Nuclear repulsion energy	3.598247

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	0.136
H2	0.000	0.000	-1.629

	Mg1	H2
Mg1		1.7648
H2	1.7648

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Mg	0.082
2	H	-0.082

	x	y	z	Total
	0.000	0.000	1.354	1.354
CHELPG
AIM
ESP

All results from a given calculation for MgH (magnesium monohydride)

using model chemistry: BLYP/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>	11.707
(<r²>)^1/2	3.422