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	hartrees
Energy at 0K	-5217.582432
Energy at 298.15K	-5217.588594
HF Energy	-5217.582432
Nuclear repulsion energy	373.051521

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	549	544	4.45
2	A₁	174	173	0.16
3	B₂	586	581	13.58

Atom	y (Å)	z (Å)
O1	0.000	0.888
Br2	1.537	-0.101
Br3	-1.537	-0.101

	O1	Br2	Br3
O1		1.8277	1.8277
Br2	1.8277		3.0735
Br3	1.8277	3.0735

Number	Element	Mulliken
1	O	-0.678
2	Br	0.339
3	Br	0.339

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

using model chemistry: LSDA/aug-cc-pVTZ

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>	197.628
(<r²>)^1/2	14.058