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	hartrees
Energy at 0K	-5195.281485
Energy at 298.15K	-5195.287694
HF Energy	-5194.878187
Nuclear repulsion energy	365.160186

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	537	514	0.06
2	A₁	185	177	0.24
3	B₂	673	643	2.74

Atom	y (Å)	z (Å)
O1	0.000	0.976
Br2	1.552	-0.112
Br3	-1.552	-0.112

	O1	Br2	Br3
O1		1.8955	1.8955
Br2	1.8955		3.1043
Br3	1.8955	3.1043

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

using model chemistry: CCD/3-21G*

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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