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	hartrees
Energy at 0K	-5219.955000
Energy at 298.15K	-5219.961193
HF Energy	-5219.483667
Nuclear repulsion energy	366.947322

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	522	499	1.18
2	A₁	185	177	0.27
3	B₂	648	619	0.19

Atom	y (Å)	z (Å)
O1	0.000	0.920
Br2	1.558	-0.105
Br3	-1.558	-0.105

	O1	Br2	Br3
O1		1.8651	1.8651
Br2	1.8651		3.1156
Br3	1.8651	3.1156

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

using model chemistry: CCD/6-311G**

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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