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	hartrees
Energy at 0K	-5163.842970
Energy at 298.15K
HF Energy	-5163.842970
Nuclear repulsion energy	242.385228

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ_g	242	232	0.00	5.09	0.08	0.15
2	Σ_u	1015	973	390.92	0.00	0.00	0.00
3	Π_u	205	197	25.42	0.00	0.00	0.00
3	Π_u	205	197	25.42	0.00	0.00	0.00

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	0.000
Br2	0.000	0.000	1.949
Br3	0.000	0.000	-1.949

	Be1	Br2	Br3
Be1		1.9485	1.9485
Br2	1.9485		3.8970
Br3	1.9485	3.8970

Number	Element	Mulliken
1	Be	-0.016
2	Br	0.008
3	Br	0.008

All results from a given calculation for BeBr₂ (Beryllium bromide)

using model chemistry: B1B95/aug-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>	292.456
(<r²>)^1/2	17.101

All results from a given calculation for BeBr2 (Beryllium bromide)

using model chemistry: B1B95/aug-cc-pVDZ

States and conformations

All results from a given calculation for BeBr₂ (Beryllium bromide)