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	hartrees
Energy at 0K	-211.777707
Energy at 298.15K
HF Energy	-211.777707
Nuclear repulsion energy	55.102980

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	856	792	0.00	37.22	0.09	0.17
2	A_g	422	390	0.00	1.43	0.75	0.85
3	B_1u	759	702	71.10	0.00	0.00	0.00
4	B_2u	827	765	167.30	0.00	0.00	0.00
5	B_3g	714	660	0.00	0.02	0.75	0.86
6	B_3u	244	226	45.36	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.122	0.000
Li2	-1.122	0.000
F3	0.000	1.189
F4	0.000	-1.189

	Li1	Li2	F3	F4
Li1		2.2448	1.6350	1.6350
Li2	2.2448		1.6350	1.6350
F3	1.6350	1.6350		2.3778
F4	1.6350	1.6350	2.3778

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	86.704		Li1	F4	Li2	86.704
F3	Li1	F4	93.296		F3	Li2	F4	93.296

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

using model chemistry: BLYP/STO-3G

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	0.042
2	Li	0.042
3	F	-0.042
4	F	-0.042

<r²>	42.415
(<r²>)^1/2	6.513

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

using model chemistry: BLYP/STO-3G

States and conformations

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