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	hartrees
Energy at 0K	-3170.763751
Energy at 298.15K	-3170.768474
HF Energy	-3169.905982
Nuclear repulsion energy	323.844730

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	3190	3040	0.09	72.01	0.19	0.32
2	A	1339	1276	10.66	3.26	0.48	0.64
3	A	1249	1190	60.19	2.04	0.36	0.53
4	A	1095	1044	172.06	2.18	0.70	0.83
5	A	809	771	182.04	3.42	0.63	0.77
6	A	686	654	42.26	12.94	0.07	0.13
7	A	432	412	0.64	4.31	0.13	0.24
8	A	321	306	0.14	2.25	0.42	0.59
9	A	230	220	0.00	2.59	0.39	0.56

Atom	x (Å)	y (Å)	z (Å)
C1	0.561	0.456	0.414
Br2	-1.191	-0.185	-0.029
Cl3	1.809	-0.683	-0.068
F4	0.771	1.640	-0.202
H5	0.606	0.592	1.488

	C1	Br2	Cl3	F4	H5
C1		1.9172	1.7570	1.3513	1.0834
Br2	1.9172		3.0412	2.6855	2.4762
Cl3	1.7570	3.0412		2.5481	2.3434
F4	1.3513	2.6855	2.5481		1.9956
H5	1.0834	2.4762	2.3434	1.9956

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.656	Br2	C1	F4	109.274
Br2	C1	H5	107.980	Cl3	C1	F4	109.433
Cl3	C1	H5	108.858	F4	C1	H5	109.610

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: MP2/aug-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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