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	hartrees
Energy at 0K	-317.611330
Energy at 298.15K	-317.611343
HF Energy	-317.611330
Nuclear repulsion energy	33.589152

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.624
O2	0.000	0.000	-1.014

	Al1	O2
Al1		1.6385
O2	1.6385

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Al	0.523
2	O	-0.523

	x	y	z	Total
	0.000	0.000	3.591	3.591
CHELPG	0.000	0.000	3.991	3.991
AIM
ESP	0.000	0.000	4.513	4.513

All results from a given calculation for AlO (Aluminum monoxide)

using model chemistry: B3LYP/6-31G*

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>	23.826
(<r²>)^1/2	4.881