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	hartrees
Energy at 0K	-3172.348858
Energy at 298.15K	-3172.353533
HF Energy	-3172.008887
Nuclear repulsion energy	320.302279

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	3202	3202	5.54	74.49	0.27	0.42
2	A	1367	1367	21.58	6.62	0.75	0.85
3	A	1265	1265	87.49	4.15	0.66	0.79
4	A	1105	1105	206.76	1.17	0.74	0.85
5	A	776	776	226.63	4.82	0.63	0.77
6	A	661	661	64.15	11.51	0.17	0.29
7	A	428	428	1.01	5.15	0.30	0.46
8	A	316	316	0.19	3.86	0.54	0.70
9	A	227	227	0.05	6.07	0.54	0.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.575	0.461	0.411
Br2	-1.211	-0.186	-0.028
Cl3	1.840	-0.683	-0.067
F4	0.781	1.641	-0.202
H5	0.618	0.597	1.485

	C1	Br2	Cl3	F4	H5
C1		1.9491	1.7721	1.3464	1.0834
Br2	1.9491		3.0912	2.7083	2.4997
Cl3	1.7721	3.0912		2.5583	2.3546
F4	1.3464	2.7083	2.5583		1.9916
H5	1.0834	2.4997	2.3546	1.9916

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.260	Br2	C1	F4	109.166
Br2	C1	H5	107.580	Cl3	C1	F4	109.490
Cl3	C1	H5	108.680	F4	C1	H5	109.622

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: B2PLYP=FULL/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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