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	hartrees
Energy at 0K	-2871.719024
Energy at 298.15K	-2871.723023
HF Energy	-2870.642234
Nuclear repulsion energy	328.827736

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	707	673	42.34
2	A₁	566	538	2.23
3	A₁	253	241	15.12
4	B₁	254	242	15.45
5	B₂	636	605	325.95
6	B₂	370	352	4.30

Atom	y (Å)	z (Å)
Br1	0.000	0.283
F2	0.000	-1.438
F3	1.805	0.168
F4	-1.805	0.168

	Br1	F2	F3	F4
Br1		1.7218	1.8087	1.8087
F2	1.7218		2.4163	2.4163
F3	1.8087	2.4163		3.6101
F4	1.8087	2.4163	3.6101

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Br1	F3	86.339		F2	Br1	F4	86.339
F3	Br1	F4	172.678

All results from a given calculation for BrF₃ (Bromine trifluoride)

using model chemistry: MP2/Def2TZVPP

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 BrF3 (Bromine trifluoride)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for BrF₃ (Bromine trifluoride)