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	hartrees
Energy at 0K	-214.529021
Energy at 298.15K	-214.528839
HF Energy	-214.529021
Nuclear repulsion energy	42.425094

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	723	723	0.00
2	Σ_u	1615	1615	262.58
3	Π_u	329	329	160.32
3	Π_u	329	329	160.32

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	0.000
F2	0.000	0.000	1.403
F3	0.000	0.000	-1.403

	Be1	F2	F3
Be1		1.4032	1.4032
F2	1.4032		2.8065
F3	1.4032	2.8065

Number	Element	Mulliken
1	Be	0.517
2	F	-0.259
3	F	-0.259

All results from a given calculation for BeF₂ (Beryllium fluoride)

using model chemistry: M06-2X/cc-pVDZ

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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<r²>	45.152
(<r²>)^1/2	6.720

All results from a given calculation for BeF2 (Beryllium fluoride)

using model chemistry: M06-2X/cc-pVDZ

States and conformations

All results from a given calculation for BeF₂ (Beryllium fluoride)