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	hartrees
Energy at 0K	-3169.713437
Energy at 298.15K	-3169.718104
HF Energy	-3169.513163
Nuclear repulsion energy	320.559348

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	3215	3058	0.58	74.61	0.25	0.40
2	A	1336	1270	15.93	4.45	0.73	0.84
3	A	1261	1199	80.91	4.08	0.50	0.67
4	A	1069	1016	202.19	1.65	0.74	0.85
5	A	789	751	207.85	4.66	0.65	0.79
6	A	659	627	63.83	14.09	0.10	0.18
7	A	426	405	1.05	4.42	0.23	0.37
8	A	314	299	0.06	3.25	0.47	0.64
9	A	226	215	0.02	4.43	0.50	0.66

Atom	x (Å)	y (Å)	z (Å)
C1	0.571	0.448	0.419
Br2	-1.209	-0.186	-0.029
Cl3	1.838	-0.681	-0.069
F4	0.779	1.643	-0.203
H5	0.612	0.593	1.493

	C1	Br2	Cl3	F4	H5
C1		1.9418	1.7652	1.3629	1.0846
Br2	1.9418		3.0871	2.7062	2.4975
Cl3	1.7652	3.0871		2.5574	2.3586
F4	1.3629	2.7062	2.5574		2.0013
H5	1.0846	2.4975	2.3586	2.0013

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.685	Br2	C1	F4	108.685
Br2	C1	H5	107.848	Cl3	C1	F4	109.006
Cl3	C1	H5	109.380	F4	C1	H5	109.180

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: B2PLYP=FULL/6-31+G**

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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