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	hartrees
Energy at 0K	-3629.873253
Energy at 298.15K	-3629.876955
HF Energy	-3628.822627
Nuclear repulsion energy	526.328161

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1154	1086	168.08
2	A'	837	788	219.27
3	A'	516	486	1.25
4	A'	346	326	0.07
5	A'	313	295	0.07
6	A'	222	209	0.02
7	A"	875	823	205.89
8	A"	403	379	0.10
9	A"	208	196	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.525	0.134	0.000
Br2	-1.399	0.324	0.000
F3	1.065	1.355	0.000
Cl4	1.065	-0.715	1.450
Cl5	1.065	-0.715	-1.450

	C1	Br2	F3	Cl4	Cl5
C1		1.9328	1.3345	1.7652	1.7652
Br2	1.9328		2.6706	3.0416	3.0416
F3	1.3345	2.6706		2.5273	2.5273
Cl4	1.7652	3.0416	2.5273		2.8998
Cl5	1.7652	3.0416	2.5273	2.8998

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	108.246	Br2	C1	Cl4	110.590
Br2	C1	Cl5	110.590	F3	C1	Cl4	108.444
F3	C1	Cl5	108.444	Cl4	C1	Cl5	110.446

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: CCSD/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)