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	hartrees
Energy at 0K	-5214.940400
Energy at 298.15K	-5214.946602
HF Energy	-5214.504667
Nuclear repulsion energy	367.078593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	533	505	1.25
2	A₁	191	181	0.24
3	B₂	654	619	0.45

Atom	y (Å)	z (Å)
O1	0.000	0.940
Br2	1.552	-0.107
Br3	-1.552	-0.107

	O1	Br2	Br3
O1		1.8726	1.8726
Br2	1.8726		3.1042
Br3	1.8726	3.1042

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

using model chemistry: CCD/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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