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	hartrees
Energy at 0K	-213.961185
Energy at 298.15K
HF Energy	-213.961185
Nuclear repulsion energy	51.949887

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	737	665	0.00	1.80	0.13	0.22
2	A_g	390	352	0.00	0.21	0.45	0.62
3	B_1u	699	631	263.24	0.00	0.00	0.00
4	B_2u	635	574	314.47	0.00	0.00	0.00
5	B_3g	617	557	0.00	0.09	0.75	0.86
6	B_3u	319	288	273.11	0.00	0.00	0.00

Atom	y (Å)	z (Å)
Li1	1.148	0.000
Li2	-1.148	0.000
F3	0.000	1.284
F4	0.000	-1.284

	Li1	Li2	F3	F4
Li1		2.2958	1.7223	1.7223
Li2	2.2958		1.7223	1.7223
F3	1.7223	1.7223		2.5679
F4	1.7223	1.7223	2.5679

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	83.595		Li1	F4	Li2	83.595
F3	Li1	F4	96.405		F3	Li2	F4	96.405

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

using model chemistry: HF/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	0.738
2	Li	0.738
3	F	-0.738
4	F	-0.738

<r²>	46.425
(<r²>)^1/2	6.814

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

using model chemistry: HF/6-31G

States and conformations

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