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	hartrees
Energy at 0K	-3170.443254
Energy at 298.15K	-3170.447967
HF Energy	-3169.777795
Nuclear repulsion energy	320.388204

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3186	3070	0.42
2	A	1324	1275	12.41
3	A	1244	1199	65.75
4	A	1086	1046	167.46
5	A	806	777	170.40
6	A	675	650	38.31
7	A	428	413	0.78
8	A	321	309	0.30
9	A	231	223	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.567	0.456	0.420
Br2	-1.205	-0.187	-0.029
Cl3	1.834	-0.686	-0.069
F4	0.776	1.653	-0.205
H5	0.615	0.597	1.506

	C1	Br2	Cl3	F4	H5
C1		1.9376	1.7746	1.3661	1.0956
Br2	1.9376		3.0795	2.7098	2.5068
Cl3	1.7746	3.0795		2.5704	2.3685
F4	1.3661	2.7098	2.5704		2.0163
H5	1.0956	2.5068	2.3685	2.0163

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.032	Br2	C1	F4	108.982
Br2	C1	H5	108.243	Cl3	C1	F4	109.157
Cl3	C1	H5	108.906	F4	C1	H5	109.489

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: CCSD/aug-cc-pVDZ

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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