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	hartrees
Energy at 0K	-3054.811295
Energy at 298.15K	-3054.816072
Nuclear repulsion energy	622.348303

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	606	578	20.97
2	A₁	523	500	0.34
3	A₁	349	333	59.44
4	B₁	260	249	0.00
5	B₂	516	492	0.00
6	B₂	200	191	0.00
7	E	651	621	143.47
7	E	651	621	143.47
8	E	349	333	10.11
8	E	349	333	10.11
9	E	193	184	5.27
9	E	193	184	5.27

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.304
F2	0.000	0.000	-1.475
F3	0.000	1.808	0.073
F4	-1.808	0.000	0.073
F5	0.000	-1.808	0.073
F6	1.808	0.000	0.073

	Br1	F2	F3	F4	F5	F6
Br1		1.7793	1.8224	1.8224	1.8224	1.8224
F2	1.7793		2.3803	2.3803	2.3803	2.3803
F3	1.8224	2.3803		2.5566	3.6155	2.5566
F4	1.8224	2.3803	2.5566		2.5566	3.6155
F5	1.8224	2.3803	3.6155	2.5566		2.5566
F6	1.8224	2.3803	2.5566	3.6155	2.5566

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	82.724	F2	Br1	F4	82.724
F2	Br1	F5	82.724	F2	Br1	F6	82.724
F3	Br1	F4	89.081	F3	Br1	F5	165.448
F3	Br1	F6	89.081	F4	Br1	F5	89.081
F4	Br1	F6	165.448	F5	Br1	F6	89.081

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

using model chemistry: MP2/3-21G

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: MP2/3-21G

States and conformations

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