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	hartrees
Energy at 0K	-3170.576929
Energy at 298.15K	-3170.581450
HF Energy	-3170.576929
Nuclear repulsion energy	317.675258

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3057	3040	3.60	72.85	0.27	0.42
2	A	1284	1277	13.43	4.53	0.72	0.84
3	A	1170	1163	62.51	2.84	0.62	0.76
4	A	1073	1067	160.72	0.86	0.63	0.78
5	A	682	679	197.34	3.72	0.41	0.58
6	A	621	617	69.76	9.21	0.10	0.18
7	A	397	394	1.46	5.79	0.19	0.32
8	A	297	296	0.94	2.89	0.49	0.65
9	A	208	207	0.01	4.53	0.44	0.61

Atom	x (Å)	y (Å)	z (Å)
C1	0.564	0.481	0.417
Br2	-1.216	-0.195	-0.029
Cl3	1.866	-0.683	-0.068
F4	0.760	1.660	-0.207
H5	0.619	0.602	1.504

	C1	Br2	Cl3	F4	H5
C1		1.9558	1.8119	1.3483	1.0952
Br2	1.9558		3.1204	2.7161	2.5203
Cl3	1.8119	3.1204		2.5942	2.3825
F4	1.3483	2.7161	2.5942		2.0168
H5	1.0952	2.5203	2.3825	2.0168

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.770	Br2	C1	F4	109.196
Br2	C1	H5	108.050	Cl3	C1	F4	109.478
Cl3	C1	H5	107.506	F4	C1	H5	110.832

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: BLYP/6-31G(2df,p)

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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Number	Element	Mulliken
1	C	-0.053
2	Br	0.028
3	Cl	-0.115
4	F	-0.023
5	H	0.164

	x	y	z	Total
	-0.059	0.336	1.116	1.167
CHELPG
AIM
ESP

	x	y	z
x	8.927	-0.331	0.037
y	-0.331	6.031	0.243
z	0.037	0.243	5.153

<r²>	183.683
(<r²>)^1/2	13.553