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	hartrees
Energy at 0K	-131.817167
Energy at 298.15K	-131.822231
Nuclear repulsion energy	166.698431

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	642	579	20.26
2	A₁	563	508	4.07
3	A₁	359	323	88.05
4	B₁	285	257	0.00
5	B₂	566	510	0.00
6	B₂	221	199	0.00
7	E	693	625	307.30
7	E	693	625	307.30
8	E	370	333	10.96
8	E	370	333	10.96
9	E	216	194	1.35
9	E	216	194	1.35

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.310
F2	0.000	0.000	-1.518
F3	0.000	1.839	0.079
F4	-1.839	0.000	0.079
F5	0.000	-1.839	0.079
F6	1.839	0.000	0.079

	Br1	F2	F3	F4	F5	F6
Br1		1.8278	1.8536	1.8536	1.8536	1.8536
F2	1.8278		2.4357	2.4357	2.4357	2.4357
F3	1.8536	2.4357		2.6010	3.6784	2.6010
F4	1.8536	2.4357	2.6010		2.6010	3.6784
F5	1.8536	2.4357	3.6784	2.6010		2.6010
F6	1.8536	2.4357	2.6010	3.6784	2.6010

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	82.843	F2	Br1	F4	82.843
F2	Br1	F5	82.843	F2	Br1	F6	82.843
F3	Br1	F4	89.111	F3	Br1	F5	165.686
F3	Br1	F6	89.111	F4	Br1	F5	89.111
F4	Br1	F6	165.686	F5	Br1	F6	89.111

All results from a given calculation for BrF₅ (bromine pentafluoride)

using model chemistry: HF/CEP-31G

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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Number	Element	Mulliken
1	Br	1.911
2	F	-0.241
3	F	-0.417
4	F	-0.417
5	F	-0.417
6	F	-0.417

	x	y	z	Total
	0.000	0.000	2.614	2.614
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for BrF5 (bromine pentafluoride)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for BrF₅ (bromine pentafluoride)