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	hartrees
Energy at 0K	-5278.735770
Energy at 298.15K
HF Energy	-5278.009610
Nuclear repulsion energy	487.757670

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3202	3028	0.78
2	A'	1368	1294	13.85
3	A'	1153	1090	137.93
4	A'	651	615	18.00
5	A'	372	352	0.33
6	A'	181	171	0.01
7	A"	1237	1170	70.16
8	A"	765	724	142.24
9	A"	311	294	0.41

Atom	x (Å)	y (Å)	z (Å)
C1	-0.104	0.780	0.000
H2	-0.998	1.396	0.000
F3	0.985	1.563	0.000
Br4	-0.104	-0.288	1.583
Br5	-0.104	-0.288	-1.583

	C1	H2	F3	Br4	Br5
C1		1.0859	1.3416	1.9090	1.9090
H2	1.0859		1.9906	2.4776	2.4776
F3	1.3416	1.9906		2.6678	2.6678
Br4	1.9090	2.4776	2.6678		3.1652
Br5	1.9090	2.4776	2.6678	3.1652

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.727	H2	C1	Br4	108.487
H2	C1	Br5	108.487	F3	C1	Br4	109.063
F3	C1	Br5	109.063	Br4	C1	Br5	111.990

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: CCSD/6-31G(2df,p)

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: CCSD/6-31G(2df,p)

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)