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	hartrees
Energy at 0K	-299.972597
Energy at 298.15K	-299.972725
Nuclear repulsion energy	31.983451

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	0.766
F2	0.000	0.000	-1.021

	Mg1	F2
Mg1		1.7869
F2	1.7869

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Mg	0.613			0.512
2	F	-0.613			-0.512

	x	y	z	Total
	0.000	0.000	3.515	3.515
CHELPG
AIM
ESP	0.000	0.000	4.391	4.391

All results from a given calculation for MgF (Magnesium monofluoride)

using model chemistry: B3LYP/6-31+G**

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>	26.426
(<r²>)^1/2	5.141