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	hartrees
Energy at 0K	-214.922277
Energy at 298.15K
HF Energy	-214.922277
Nuclear repulsion energy	51.650473

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	709	681	0.00	7.65	0.05	0.10
2	A_g	371	356	0.00	0.19	0.49	0.66
3	B_1u	706	677	219.36	0.00	0.00	0.00
4	B_2u	590	566	288.46	0.00	0.00	0.00
5	B_3g	583	559	0.00	1.00	0.75	0.86
6	B_3u	291	279	179.01	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.108	0.000
Li2	-1.108	0.000
F3	0.000	1.316
F4	0.000	-1.316

	Li1	Li2	F3	F4
Li1		2.2151	1.7204	1.7204
Li2	2.2151		1.7204	1.7204
F3	1.7204	1.7204		2.6329
F4	1.7204	1.7204	2.6329

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	80.150		Li1	F4	Li2	80.150
F3	Li1	F4	99.850		F3	Li2	F4	99.850

All results from a given calculation for Li₂F₂ (Lithium fluoride dimer)

using model chemistry: TPSSh/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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Number	Element	Mulliken
1	Li	0.526
2	Li	0.526
3	F	-0.526
4	F	-0.526

<r²>	47.710
(<r²>)^1/2	6.907

All results from a given calculation for Li2F2 (Lithium fluoride dimer)

using model chemistry: TPSSh/6-31G*

States and conformations

All results from a given calculation for Li₂F₂ (Lithium fluoride dimer)