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	hartrees
Energy at 0K	-211.835236
Energy at 298.15K
HF Energy	-211.835236
Nuclear repulsion energy	56.076542

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	924	924	0.00	13.18	0.11	0.20
2	A_g	454	454	0.00	0.59	0.75	0.86
3	B_1u	853	853	107.36	0.00	0.00	0.00
4	B_2u	895	895	217.63	0.00	0.00	0.00
5	B_3g	801	801	0.00	0.03	0.75	0.86
6	B_3u	300	300	75.38	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.105	0.000
Li2	-1.105	0.000
F3	0.000	1.167
F4	0.000	-1.167

	Li1	Li2	F3	F4
Li1		2.2093	1.6071	1.6071
Li2	2.2093		1.6071	1.6071
F3	1.6071	1.6071		2.3346
F4	1.6071	1.6071	2.3346

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	86.842		Li1	F4	Li2	86.842
F3	Li1	F4	93.158		F3	Li2	F4	93.158

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

using model chemistry: M06-2X/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	0.116
2	Li	0.116
3	F	-0.116
4	F	-0.116

<r²>	40.814
(<r²>)^1/2	6.389

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

using model chemistry: M06-2X/STO-3G

States and conformations

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