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	hartrees
Energy at 0K	-3170.409684
Energy at 298.15K	-3170.414411
HF Energy	-3169.775555
Nuclear repulsion energy	321.202289

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3184	3049	6.85
2	A	1381	1322	23.75
3	A	1288	1233	84.82
4	A	1135	1087	191.25
5	A	817	782	194.71
6	A	677	648	49.06
7	A	436	417	1.18
8	A	323	310	0.18
9	A	233	223	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.573	0.457	0.411
Br2	-1.207	-0.185	-0.028
Cl3	1.833	-0.682	-0.068
F4	0.779	1.638	-0.202
H5	0.618	0.598	1.489

	C1	Br2	Cl3	F4	H5
C1		1.9418	1.7649	1.3475	1.0877
Br2	1.9418		3.0803	2.7016	2.4992
Cl3	1.7649	3.0803		2.5524	2.3531
F4	1.3475	2.7016	2.5524		1.9917
H5	1.0877	2.4992	2.3531	1.9917

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.318	Br2	C1	F4	109.095
Br2	C1	H5	107.806	Cl3	C1	F4	109.456
Cl3	C1	H5	108.828	F4	C1	H5	109.284

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: QCISD/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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