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	hartrees
Energy at 0K	-3167.841171
Energy at 298.15K	-3167.845898
HF Energy	-3167.257627
Nuclear repulsion energy	321.369359

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3250	3063	1.15
2	A	1367	1288	20.31
3	A	1296	1222	80.39
4	A	1111	1046	182.03
5	A	839	791	168.09
6	A	676	637	48.65
7	A	435	410	1.69
8	A	322	303	0.58
9	A	232	219	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.573	0.441	0.419
Br2	-1.206	-0.184	-0.029
Cl3	1.831	-0.680	-0.069
F4	0.781	1.639	-0.202
H5	0.614	0.591	1.491

	C1	Br2	Cl3	F4	H5
C1		1.9383	1.7538	1.3655	1.0834
Br2	1.9383		3.0773	2.7020	2.4949
Cl3	1.7538	3.0773		2.5492	2.3519
F4	1.3655	2.7020	2.5492		1.9983
H5	1.0834	2.4949	2.3519	1.9983

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.818	Br2	C1	F4	108.491
Br2	C1	H5	107.943	Cl3	C1	F4	108.979
Cl3	C1	H5	109.708	F4	C1	H5	108.822

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: CCD/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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