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	hartrees
Energy at 0K	-42.300772
Energy at 298.15K	-42.309081
HF Energy	-42.168151
Nuclear repulsion energy	39.854877

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	263	256	0.00
2	A₂"	381	372	0.91
3	E'	789	770	330.34
3	E'	789	770	330.34
4	E'	156	152	0.08
4	E'	156	152	0.08

Atom	x (Å)	y (Å)
B1	0.000	0.000
Br2	0.000	1.963
Br3	1.700	-0.982
Br4	-1.700	-0.982

	B1	Br2	Br3	Br4
B1		1.9634	1.9634	1.9634
Br2	1.9634		3.4006	3.4006
Br3	1.9634	3.4006		3.4006
Br4	1.9634	3.4006	3.4006

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	B1	Br3	120.000		Br2	B1	Br4	120.000
Br3	B1	Br4	120.000

All results from a given calculation for BBr₃ (Boron tribromide)

using model chemistry: MP2/CEP-121G

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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All results from a given calculation for BBr3 (Boron tribromide)

using model chemistry: MP2/CEP-121G

States and conformations

All results from a given calculation for BBr₃ (Boron tribromide)