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	hartrees
Energy at 0K	-5737.217780
Energy at 298.15K
HF Energy	-5736.523037
Nuclear repulsion energy	730.169772

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1150	1073	153.31
2	A'	859	801	200.72
3	A'	473	441	1.65
4	A'	345	322	0.13
5	A'	276	257	0.10
6	A'	171	159	0.02
7	A"	774	722	203.29
8	A"	311	290	0.04
9	A"	205	192	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	-0.128	0.520	0.000
F2	-1.269	1.241	0.000
Cl3	1.242	1.622	0.000
Br4	-0.128	-0.598	1.599
Br5	-0.128	-0.598	-1.599

	C1	F2	Cl3	Br4	Br5
C1		1.3500	1.7576	1.9509	1.9509
F2	1.3500		2.5396	2.6909	2.6909
Cl3	1.7576	2.5396		3.0591	3.0591
Br4	1.9509	2.6909	3.0591		3.1974
Br5	1.9509	2.6909	3.0591	3.1974

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	108.914	F2	C1	Br4	107.825
F2	C1	Br5	107.825	Cl3	C1	Br4	111.047
Cl3	C1	Br5	111.047	Br4	C1	Br5	110.064

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)

using model chemistry: CCSD/6-31G**

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**

States and conformations

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)