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	hartrees
Energy at 0K	-5220.042655
Energy at 298.15K	-5220.048858
HF Energy	-5219.521722
Nuclear repulsion energy	367.687955

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	528	511	2.96
2	A₁	185	179	0.22
3	B₂	658	637	2.53

Atom	y (Å)	z (Å)
O1	0.000	0.951
Br2	1.546	-0.109
Br3	-1.546	-0.109

	O1	Br2	Br3
O1		1.8747	1.8747
Br2	1.8747		3.0926
Br3	1.8747	3.0926

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

using model chemistry: MP2=FULL/aug-cc-pVDZ

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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