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	hartrees
Energy at 0K	-300.004706
Energy at 298.15K	-300.004824
HF Energy	-300.004706
Nuclear repulsion energy	31.853704

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	0.769
F2	0.000	0.000	-1.025

	Mg1	F2
Mg1		1.7942
F2	1.7942

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

using model chemistry: B3LYP/TZVP

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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