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	hartrees
Energy at 0K	-2869.848091
Energy at 298.15K
HF Energy	-2869.082084
Nuclear repulsion energy	188.607728

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.976
Br2	0.000	0.000	-1.479

	I1	Br2
I1		2.4549
Br2	2.4549

Number	Element	Mulliken	CHELPG	AIM	ESP
1	I	0.146
2	Br	-0.146

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

All results from a given calculation for IBr (Iodine monobromide)

using model chemistry: ROMP2/Def2TZVPP

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>	128.029
(<r²>)^1/2	11.315