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	hartrees
Energy at 0K	-2650.535373
Energy at 298.15K
HF Energy	-2650.535373
Nuclear repulsion energy	84.168504

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.328
O2	0.000	0.000	-1.433

	Br1	O2
Br1		1.7604
O2	1.7604

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Br	0.538
2	O	-0.538

	x	y	z	Total
	0.000	0.000	1.766	1.766
CHELPG
AIM
ESP

All results from a given calculation for BrO (Bromine monoxide)

using model chemistry: B97D3/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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<r²>	34.811
(<r²>)^1/2	5.900