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	hartrees
Energy at 0K	-399.841602
Energy at 298.15K	-399.841920
HF Energy	-399.841602
Nuclear repulsion energy	76.958129

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	561	540	0.00
2	Σ_u	892	859	107.18
3	Π_u	146	140	131.49
3	Π_u	146	140	131.49

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	0.000
F2	0.000	0.000	1.764
F3	0.000	0.000	-1.764

	Mg1	F2	F3
Mg1		1.7637	1.7637
F2	1.7637		3.5275
F3	1.7637	3.5275

Number	Element	Mulliken
1	Mg	1.130
2	F	-0.565
3	F	-0.565

All results from a given calculation for MgF₂ (Magnesium fluoride)

using model chemistry: B3PW91/6-311G**

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>	69.585
(<r²>)^1/2	8.342

All results from a given calculation for MgF2 (Magnesium fluoride)

using model chemistry: B3PW91/6-311G**

States and conformations

All results from a given calculation for MgF₂ (Magnesium fluoride)