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	hartrees
Energy at 0K	-3067.849434
Energy at 298.15K	-3067.854872
HF Energy	-3066.730930
Nuclear repulsion energy	635.230957

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	710	662	44.32
2	A₁	613	571	2.29
3	A₁	385	359	45.24
4	B₁	321	299	0.00
5	B₂	589	548	0.00
6	B₂	235	219	0.00
7	E	685	639	344.93
7	E	685	639	344.93
8	E	424	395	6.48
8	E	424	395	6.48
9	E	249	232	0.44
9	E	249	232	0.44

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.274
F2	0.000	0.000	-1.457
F3	0.000	1.779	0.098
F4	-1.779	0.000	0.098
F5	0.000	-1.779	0.098
F6	1.779	0.000	0.098

	Br1	F2	F3	F4	F5	F6
Br1		1.7312	1.7872	1.7872	1.7872	1.7872
F2	1.7312		2.3628	2.3628	2.3628	2.3628
F3	1.7872	2.3628		2.5153	3.5572	2.5153
F4	1.7872	2.3628	2.5153		2.5153	3.5572
F5	1.7872	2.3628	3.5572	2.5153		2.5153
F6	1.7872	2.3628	2.5153	3.5572	2.5153

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	84.358	F2	Br1	F4	84.358
F2	Br1	F5	84.358	F2	Br1	F6	84.358
F3	Br1	F4	89.446	F3	Br1	F5	168.716
F3	Br1	F6	89.446	F4	Br1	F5	89.446
F4	Br1	F6	168.716	F5	Br1	F6	89.446

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

using model chemistry: MP3=FULL/6-31+G**

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: MP3=FULL/6-31+G**

States and conformations

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