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	hartrees
Energy at 0K	-2723.931969
Energy at 298.15K
HF Energy	-2723.698146
Nuclear repulsion energy	191.380570

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	824	824	4.05	1820557.00	0.33	0.50
2	A₁	319	319	14.27	757.98	0.36	0.52
3	B₂	951	951	2022.80	23208.79	0.75	0.86

Atom	y (Å)	z (Å)
Br1	0.000	0.279
O2	1.393	-0.611
O3	-1.393	-0.611

	Br1	O2	O3
Br1		1.6534	1.6534
O2	1.6534		2.7863
O3	1.6534	2.7863

Number	Element	Mulliken
1	Br	0.993
2	O	-0.496
3	O	-0.496

All results from a given calculation for OBrO (Bromine dioxide radical)

using model chemistry: B2PLYP/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>	58.457
(<r²>)^1/2	7.646