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	hartrees
Energy at 0K	-5258.148011
Energy at 298.15K
HF Energy	-5257.651295
Nuclear repulsion energy	479.015189

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	3039	4.00	72.24	0.27	0.43
2	A'	1361	1290	19.49	7.42	0.75	0.86
3	A'	1101	1044	103.25	2.26	0.75	0.86
4	A'	640	607	24.77	9.55	0.10	0.19
5	A'	348	330	0.85	4.41	0.24	0.39
6	A'	175	165	0.06	3.47	0.51	0.68
7	A"	1258	1192	82.50	5.22	0.75	0.86
8	A"	718	680	178.42	5.19	0.75	0.86
9	A"	282	267	0.42	2.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.106	0.813	0.000
H2	-1.023	1.395	0.000
F3	1.011	1.646	0.000
Br4	-0.106	-0.301	1.595
Br5	-0.106	-0.301	-1.595

	C1	H2	F3	Br4	Br5
C1		1.0859	1.3930	1.9461	1.9461
H2	1.0859		2.0493	2.5025	2.5025
F3	1.3930	2.0493		2.7538	2.7538
Br4	1.9461	2.5025	2.7538		3.1905
Br5	1.9461	2.5025	2.7538	3.1905

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.914	H2	C1	Br4	107.865
H2	C1	Br5	107.865	F3	C1	Br4	110.016
F3	C1	Br5	110.016	Br4	C1	Br5	110.116

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: MP2=FULL/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=FULL/3-21G*

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)