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	hartrees
Energy at 0K	-3170.490521
Energy at 298.15K	-3170.495179
HF Energy	-3169.777040
Nuclear repulsion energy	319.313518

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3164	3086
2	A	1295	1262
3	A	1218	1188
4	A	1034	1008
5	A	782	763
6	A	658	642
7	A	418	408
8	A	313	305
9	A	227	221

Atom	x (Å)	y (Å)	z (Å)
C1	0.570	0.456	0.423
Br2	-1.208	-0.188	-0.029
Cl3	1.837	-0.689	-0.070
F4	0.780	1.662	-0.205
H5	0.616	0.597	1.510

	C1	Br2	Cl3	F4	H5
C1		1.9442	1.7778	1.3758	1.0972
Br2	1.9442		3.0870	2.7210	2.5127
Cl3	1.7778	3.0870		2.5813	2.3754
F4	1.3758	2.7210	2.5813		2.0252
H5	1.0972	2.5127	2.3754	2.0252

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.998	Br2	C1	F4	108.876
Br2	C1	H5	108.161	Cl3	C1	F4	109.214
Cl3	C1	H5	109.125	F4	C1	H5	109.433

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: MP4=FULL/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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