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	hartrees
Energy at 0K	-5258.123873
Energy at 298.15K
HF Energy	-5257.651267
Nuclear repulsion energy	478.773140

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3206	3049	4.02	72.26	0.27	0.43
2	A'	1361	1295	19.49	7.42	0.75	0.86
3	A'	1101	1047	103.35	2.26	0.75	0.86
4	A'	640	609	24.92	9.54	0.10	0.19
5	A'	348	331	0.85	4.43	0.24	0.39
6	A'	174	166	0.06	3.49	0.51	0.68
7	A"	1258	1197	82.79	5.22	0.75	0.86
8	A"	716	681	179.42	5.20	0.75	0.86
9	A"	282	268	0.40	2.52	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.106	0.813	0.000
H2	-1.023	1.394	0.000
F3	1.011	1.646	0.000
Br4	-0.106	-0.301	1.597
Br5	-0.106	-0.301	-1.597

	C1	H2	F3	Br4	Br5
C1		1.0860	1.3932	1.9468	1.9468
H2	1.0860		2.0495	2.5031	2.5031
F3	1.3932	2.0495		2.7544	2.7544
Br4	1.9468	2.5031	2.7544		3.1931
Br5	1.9468	2.5031	2.7544	3.1931

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.910	H2	C1	Br4	107.846
H2	C1	Br5	107.846	F3	C1	Br4	110.004
F3	C1	Br5	110.004	Br4	C1	Br5	110.184

All results from a given calculation for CHBr₂F (dibromofluoromethane)

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 CHBr2F (dibromofluoromethane)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)