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	hartrees
Energy at 0K	-3629.531021
Energy at 298.15K	-3629.534860
HF Energy	-3628.721664
Nuclear repulsion energy	530.642524

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1197	1104	159.59
2	A'	883	814	216.62
3	A'	544	501	1.05
4	A'	363	334	0.20
5	A'	329	304	0.16
6	A'	235	216	0.06
7	A"	929	856	203.98
8	A"	423	390	0.26
9	A"	219	202	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.524	0.128	0.000
Br2	-1.389	0.324	0.000
F3	1.058	1.337	0.000
Cl4	1.058	-0.710	1.437
Cl5	1.058	-0.710	-1.437

	C1	Br2	F3	Cl4	Cl5
C1		1.9234	1.3209	1.7467	1.7467
Br2	1.9234		2.6487	3.0201	3.0201
F3	1.3209	2.6487		2.5002	2.5002
Cl4	1.7467	3.0201	2.5002		2.8733
Cl5	1.7467	3.0201	2.5002	2.8733

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	108.009	Br2	C1	Cl4	110.658
Br2	C1	Cl5	110.658	F3	C1	Cl4	108.377
F3	C1	Cl5	108.377	Cl4	C1	Cl5	110.665

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: CISD/6-311+G(3df,2p)

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 CBrCl2F (bromodichlorofluoromethane)

using model chemistry: CISD/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)