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	hartrees
Energy at 0K	-5226.010168
Energy at 298.15K	-5226.016246
HF Energy	-5226.010168
Nuclear repulsion energy	363.624402

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	505	498	3.43
2	A₁	171	169	0.15
3	B₂	518	512	21.61

Atom	y (Å)	z (Å)
O1	0.000	0.898
Br2	1.580	-0.103
Br3	-1.580	-0.103

	O1	Br2	Br3
O1		1.8701	1.8701
Br2	1.8701		3.1597
Br3	1.8701	3.1597

Number	Element	Mulliken
1	O	-0.398
2	Br	0.199
3	Br	0.199

All results from a given calculation for BrOBr (Bromine oxide)

using model chemistry: B97D3/6-311+G(3df,2p)

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>	207.028
(<r²>)^1/2	14.388