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	hartrees
Energy at 0K	-272.827820
Energy at 298.15K	-272.827972
Nuclear repulsion energy	29.396127

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	0.691
O2	0.000	0.000	-1.037

	Mg1	O2
Mg1		1.7282
O2	1.7282

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Mg	0.558	0.867
2	O	-0.558	-0.867

	x	y	z	Total
	0.000	0.000	6.852	6.852
CHELPG	0.000	0.000	7.195	7.195
AIM
ESP

All results from a given calculation for MgO (magnesium oxide)

using model chemistry: HF/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>	23.245
(<r²>)^1/2	4.821