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	hartrees
Energy at 0K	-3155.284692
Energy at 298.15K	-3155.289301
HF Energy	-3154.780790
Nuclear repulsion energy	317.575385

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3169	3046	6.03
2	A	1361	1308	15.89
3	A	1287	1237	66.60
4	A	1102	1059	99.57
5	A	738	709	183.34
6	A	664	638	35.53
7	A	398	383	1.80
8	A	297	286	0.65
9	A	227	218	0.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.571	0.467	0.429
Br2	-1.211	-0.186	-0.030
Cl3	1.829	-0.708	-0.070
F4	0.803	1.686	-0.205
H5	0.616	0.580	1.510

	C1	Br2	Cl3	F4	H5
C1		1.9519	1.7930	1.3935	1.0877
Br2	1.9519		3.0846	2.7552	2.5085
Cl3	1.7930	3.0846		2.6086	2.3725
F4	1.3935	2.7552	2.6086		2.0491
H5	1.0877	2.5085	2.3725	2.0491

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	110.840	Br2	C1	F4	109.766
Br2	C1	H5	107.823	Cl3	C1	F4	109.258
Cl3	C1	H5	108.391	F4	C1	H5	110.747

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: QCISD/3-21G*

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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