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	hartrees
Energy at 0K	-214.842680
Energy at 298.15K
HF Energy	-214.842680
Nuclear repulsion energy	50.827083

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	672	672	0.00	12.36	0.05	0.10
2	A_g	360	360	0.00	0.24	0.44	0.61
3	B_1u	675	675	212.78	0.00	0.00	0.00
4	B_2u	556	556	285.62	0.00	0.00	0.00
5	B_3g	549	549	0.00	1.20	0.75	0.86
6	B_3u	285	285	173.22	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.122	0.000
Li2	-1.122	0.000
F3	0.000	1.340
F4	0.000	-1.340

	Li1	Li2	F3	F4
Li1		2.2437	1.7474	1.7474
Li2	2.2437		1.7474	1.7474
F3	1.7474	1.7474		2.6794
F4	1.7474	1.7474	2.6794

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	79.885		Li1	F4	Li2	79.885
F3	Li1	F4	100.115		F3	Li2	F4	100.115

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

using model chemistry: B97D3/6-31G**

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	0.509
2	Li	0.509
3	F	-0.509
4	F	-0.509

<r²>	49.130
(<r²>)^1/2	7.009

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

using model chemistry: B97D3/6-31G**

States and conformations

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