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	hartrees
Energy at 0K	-3170.387770
Energy at 298.15K	-3170.392498
HF Energy	-3169.759415
Nuclear repulsion energy	320.803709

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3224	3031	5.66
2	A	1361	1280	23.65
3	A	1253	1178	79.66
4	A	1162	1093	192.70
5	A	813	765	181.49
6	A	675	635	45.99
7	A	434	408	1.27
8	A	323	304	0.13
9	A	230	217	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.572	0.463	0.411
Br2	-1.207	-0.186	-0.028
Cl3	1.834	-0.684	-0.067
F4	0.778	1.643	-0.203
H5	0.614	0.595	1.497

	C1	Br2	Cl3	F4	H5
C1		1.9438	1.7719	1.3455	1.0945
Br2	1.9438		3.0816	2.7050	2.5000
Cl3	1.7719	3.0816		2.5589	2.3605
F4	1.3455	2.7050	2.5589		2.0037
H5	1.0945	2.5000	2.3605	2.0037

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.981	Br2	C1	F4	109.294
Br2	C1	H5	107.415	Cl3	C1	F4	109.580
Cl3	C1	H5	108.552	F4	C1	H5	109.984

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: MP3=FULL/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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