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	hartrees
Energy at 0K	-5745.631182
Energy at 298.15K
HF Energy	-5745.154849
Nuclear repulsion energy	731.563731

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1080	1080	163.27	2.71	0.52	0.69
2	A'	798	798	212.72	5.42	0.57	0.73
3	A'	466	466	0.70	8.53	0.02	0.04
4	A'	344	344	0.07	3.02	0.45	0.62
5	A'	269	269	0.37	6.54	0.17	0.29
6	A'	161	161	0.06	2.49	0.61	0.76
7	A"	750	750	222.52	7.27	0.75	0.86
8	A"	311	311	0.10	2.74	0.75	0.86
9	A"	196	196	0.07	2.42	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.132	0.513	0.000
F2	-1.254	1.245	0.000
Cl3	1.252	1.605	0.000
Br4	-0.132	-0.594	1.599
Br5	-0.132	-0.594	-1.599

	C1	F2	Cl3	Br4	Br5
C1		1.3407	1.7629	1.9445	1.9445
F2	1.3407		2.5324	2.6833	2.6833
Cl3	1.7629	2.5324		3.0505	3.0505
Br4	1.9445	2.6833	3.0505		3.1982
Br5	1.9445	2.6833	3.0505	3.1982

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	108.599	F2	C1	Br4	108.114
F2	C1	Br5	108.114	Cl3	C1	Br4	110.637
Cl3	C1	Br5	110.637	Br4	C1	Br5	110.644

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)

using model chemistry: B2PLYP=FULL/Def2TZVPP

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: B2PLYP=FULL/Def2TZVPP

States and conformations

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)