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	hartrees
Energy at 0K	-214.995990
Energy at 298.15K
HF Energy	-214.995990
Nuclear repulsion energy	51.476110

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	690	665	0.00	5.28	0.08	0.16
2	A_g	364	350	0.00	0.38	0.45	0.62
3	B_1u	697	672	238.16	0.00	0.00	0.00
4	B_2u	588	566	274.36	0.00	0.00	0.00
5	B_3g	582	560	0.00	0.68	0.75	0.86
6	B_3u	286	276	188.40	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.112	0.000
Li2	-1.112	0.000
F3	0.000	1.320
F4	0.000	-1.320

	Li1	Li2	F3	F4
Li1		2.2245	1.7264	1.7264
Li2	2.2245		1.7264	1.7264
F3	1.7264	1.7264		2.6408
F4	1.7264	1.7264	2.6408

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	80.221		Li1	F4	Li2	80.221
F3	Li1	F4	99.779		F3	Li2	F4	99.779

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

using model chemistry: TPSSh/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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Number	Element	Mulliken
1	Li	0.572
2	Li	0.572
3	F	-0.572
4	F	-0.572

<r²>	47.858
(<r²>)^1/2	6.918

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

using model chemistry: TPSSh/6-311G*

States and conformations

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