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	hartrees
Energy at 0K	-2857.286814
Energy at 298.15K	-2857.290888
HF Energy	-2856.780147
Nuclear repulsion energy	325.699903

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	702	672	9.83
2	A₁	607	581	0.46
3	A₁	270	258	17.27
4	B₁	259	248	16.15
5	B₂	727	695	186.29
6	B₂	359	343	6.92

Atom	y (Å)	z (Å)
Br1	0.000	0.307
F2	0.000	-1.462
F3	1.803	0.134
F4	-1.803	0.134

	Br1	F2	F3	F4
Br1		1.7695	1.8117	1.8117
F2	1.7695		2.4085	2.4085
F3	1.8117	2.4085		3.6068
F4	1.8117	2.4085	3.6068

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Br1	F3	84.521		F2	Br1	F4	84.521
F3	Br1	F4	169.043

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

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 BrF3 (Bromine trifluoride)

using model chemistry: CCD/3-21G*

States and conformations

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