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	hartrees
Energy at 0K	-5737.809077
Energy at 298.15K
HF Energy	-5736.897988
Nuclear repulsion energy	739.955347

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1155	1092	128.09
2	A'	849	803	177.14
3	A'	477	451	0.54
4	A'	356	336	0.13
5	A'	280	265	0.10
6	A'	172	162	0.02
7	A"	816	772	173.85
8	A"	326	308	0.32
9	A"	203	192	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	-0.132	0.496	0.000
F2	-1.248	1.227	0.000
Cl3	1.251	1.597	0.000
Br4	-0.132	-0.588	1.575
Br5	-0.132	-0.588	-1.575

	C1	F2	Cl3	Br4	Br5
C1		1.3339	1.7674	1.9117	1.9117
F2	1.3339		2.5255	2.6492	2.6492
Cl3	1.7674	2.5255		3.0273	3.0273
Br4	1.9117	2.6492	3.0273		3.1497
Br5	1.9117	2.6492	3.0273	3.1497

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	108.234	F2	C1	Br4	108.098
F2	C1	Br5	108.098	Cl3	C1	Br4	110.681
Cl3	C1	Br5	110.681	Br4	C1	Br5	110.936

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)

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 CBr2ClF (dibromochlorofluoromethane)

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

States and conformations

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)