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	hartrees
Energy at 0K	-2868.642648
Energy at 298.15K	-2868.646637
HF Energy	-2867.960423
Nuclear repulsion energy	325.201126

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	702	663	23.55
2	A₁	589	557	0.76
3	A₁	254	240	15.67
4	B₁	255	241	15.46
5	B₂	657	621	268.82
6	B₂	354	334	4.77

Atom	y (Å)	z (Å)
Br1	0.000	0.298
F2	0.000	-1.452
F3	1.818	0.146
F4	-1.818	0.146

	Br1	F2	F3	F4
Br1		1.7499	1.8244	1.8244
F2	1.7499		2.4199	2.4199
F3	1.8244	2.4199		3.6360
F4	1.8244	2.4199	3.6360

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Br1	F3	85.192		F2	Br1	F4	85.192
F3	Br1	F4	170.384

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

using model chemistry: CCSD/6-31G*

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

using model chemistry: CCSD/6-31G*

States and conformations

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