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	hartrees
Energy at 0K	-3055.237989
Energy at 298.15K	-3055.243657
Nuclear repulsion energy	639.367663

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	739	707	34.50
2	A₁	654	626	0.79
3	A₁	417	399	51.64
4	B₁	331	316	0.00
5	B₂	644	616	0.00
6	B₂	252	241	0.00
7	E	784	750	213.82
7	E	784	750	213.82
8	E	421	403	13.48
8	E	421	403	13.48
9	E	261	250	2.07
9	E	261	250	2.07

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.284
F2	0.000	0.000	-1.461
F3	0.000	1.757	0.090
F4	-1.757	0.000	0.090
F5	0.000	-1.757	0.090
F6	1.757	0.000	0.090

	Br1	F2	F3	F4	F5	F6
Br1		1.7442	1.7676	1.7676	1.7676	1.7676
F2	1.7442		2.3430	2.3430	2.3430	2.3430
F3	1.7676	2.3430		2.4846	3.5138	2.4846
F4	1.7676	2.3430	2.4846		2.4846	3.5138
F5	1.7676	2.3430	3.5138	2.4846		2.4846
F6	1.7676	2.3430	2.4846	3.5138	2.4846

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	83.698	F2	Br1	F4	83.698
F2	Br1	F5	83.698	F2	Br1	F6	83.698
F3	Br1	F4	89.310	F3	Br1	F5	167.396
F3	Br1	F6	89.310	F4	Br1	F5	89.310
F4	Br1	F6	167.396	F5	Br1	F6	89.310

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

using model chemistry: CCD/3-21G*

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 BrF5 (bromine pentafluoride)

using model chemistry: CCD/3-21G*

States and conformations

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