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	hartrees
Energy at 0K	-5742.770910
Energy at 298.15K
HF Energy	-5741.643940
Nuclear repulsion energy	730.017693

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1131	1071	180.95
2	A'	846	801	200.40
3	A'	474	450	1.01
4	A'	353	335	0.06
5	A'	274	259	0.19
6	A'	165	156	0.06
7	A"	789	748	209.62
8	A"	319	302	0.06
9	A"	201	191	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	-0.131	0.509	0.000
F2	-1.256	1.236	0.000
Cl3	1.249	1.621	0.000
Br4	-0.131	-0.596	1.603
Br5	-0.131	-0.596	-1.603

	C1	F2	Cl3	Br4	Br5
C1		1.3396	1.7717	1.9466	1.9466
F2	1.3396		2.5335	2.6816	2.6816
Cl3	1.7717	2.5335		3.0636	3.0636
Br4	1.9466	2.6816	3.0636		3.2056
Br5	1.9466	2.6816	3.0636	3.2056

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	108.233	F2	C1	Br4	107.945
F2	C1	Br5	107.945	Cl3	C1	Br4	110.870
Cl3	C1	Br5	110.870	Br4	C1	Br5	110.848

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)

using model chemistry: CCSD=FULL/TZVP

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=FULL/TZVP

States and conformations

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)