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	hartrees
Energy at 0K	-214.852634
Energy at 298.15K
HF Energy	-214.852634
Nuclear repulsion energy	51.799251

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	724	690	0.00	7.19	0.10	0.18
2	A_g	374	357	0.00	0.41	0.44	0.61
3	B_1u	697	665	223.87	0.00	0.00	0.00
4	B_2u	626	597	292.65	0.00	0.00	0.00
5	B_3g	613	585	0.00	0.22	0.75	0.86
6	B_3u	298	285	229.26	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.154	0.000
Li2	-1.154	0.000
F3	0.000	1.286
F4	0.000	-1.286

	Li1	Li2	F3	F4
Li1		2.3083	1.7281	1.7281
Li2	2.3083		1.7281	1.7281
F3	1.7281	1.7281		2.5723
F4	1.7281	1.7281	2.5723

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	83.809		Li1	F4	Li2	83.809
F3	Li1	F4	96.191		F3	Li2	F4	96.191

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

using model chemistry: B1B95/6-31G

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	0.627
2	Li	0.627
3	F	-0.627
4	F	-0.627

<r²>	46.943
(<r²>)^1/2	6.852

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

using model chemistry: B1B95/6-31G

States and conformations

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