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	hartrees
Energy at 0K	-3629.462249
Energy at 298.15K	-3629.465963
HF Energy	-3628.681571
Nuclear repulsion energy	524.245835

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1143	1090	188.86
2	A'	834	795	247.20
3	A'	516	492	1.85
4	A'	350	334	0.04
5	A'	315	301	0.11
6	A'	229	218	0.14
7	A"	883	842	240.82
8	A"	408	389	0.15
9	A"	213	203	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.529	0.122	0.000
Br2	-1.407	0.332	0.000
F3	1.071	1.347	0.000
Cl4	1.071	-0.720	1.455
Cl5	1.071	-0.720	-1.455

	C1	Br2	F3	Cl4	Cl5
C1		1.9468	1.3398	1.7660	1.7660
Br2	1.9468		2.6779	3.0595	3.0595
F3	1.3398	2.6779		2.5276	2.5276
Cl4	1.7660	3.0595	2.5276		2.9093
Cl5	1.7660	3.0595	2.5276	2.9093

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	107.703	Br2	C1	Cl4	110.888
Br2	C1	Cl5	110.888	F3	C1	Cl4	108.157
F3	C1	Cl5	108.157	Cl4	C1	Cl5	110.912

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: CCSD/6-311G*

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: CCSD/6-311G*

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)