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	hartrees
Energy at 0K	-214.960284
Energy at 298.15K
HF Energy	-214.960284
Nuclear repulsion energy	51.220659

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	697	697	0.00	3.24	0.10	0.17
2	A_g	361	361	0.00	0.33	0.39	0.56
3	B_1u	717	717	250.29	0.00	0.00	0.00
4	B_2u	593	593	285.67	0.00	0.00	0.00
5	B_3g	604	604	0.00	0.51	0.75	0.86
6	B_3u	291	291	201.11	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.103	0.000
Li2	-1.103	0.000
F3	0.000	1.335
F4	0.000	-1.335

	Li1	Li2	F3	F4
Li1		2.2066	1.7316	1.7316
Li2	2.2066		1.7316	1.7316
F3	1.7316	1.7316		2.6693
F4	1.7316	1.7316	2.6693

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	79.158		Li1	F4	Li2	79.158
F3	Li1	F4	100.842		F3	Li2	F4	100.842

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

using model chemistry: wB97X-D/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	0.589
2	Li	0.589
3	F	-0.589
4	F	-0.589

<r²>	48.446
(<r²>)^1/2	6.960

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

using model chemistry: wB97X-D/6-311G*

States and conformations

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