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	hartrees
Energy at 0K	-3172.944084
Energy at 298.15K	-3172.948713
HF Energy	-3172.944084
Nuclear repulsion energy	318.625110

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	3164	3058	3.96	76.52	0.26	0.41
2	A	1337	1292	19.24	6.22	0.74	0.85
3	A	1223	1183	82.71	3.62	0.64	0.78
4	A	1096	1059	213.29	1.06	0.74	0.85
5	A	742	717	234.91	4.74	0.60	0.75
6	A	641	620	72.04	11.38	0.17	0.30
7	A	419	405	1.09	5.43	0.30	0.46
8	A	308	298	0.58	3.99	0.53	0.69
9	A	220	213	0.06	6.50	0.53	0.69

Atom	x (Å)	y (Å)	z (Å)
C1	0.578	0.467	0.412
Br2	-1.219	-0.187	-0.028
Cl3	1.853	-0.685	-0.067
F4	0.784	1.645	-0.203
H5	0.619	0.593	1.488

	C1	Br2	Cl3	F4	H5
C1		1.9623	1.7835	1.3454	1.0846
Br2	1.9623		3.1121	2.7203	2.5070
Cl3	1.7835	3.1121		2.5676	2.3617
F4	1.3454	2.7203	2.5676		1.9988
H5	1.0846	2.5070	2.3617	1.9988

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.280	Br2	C1	F4	109.234
Br2	C1	H5	107.192	Cl3	C1	F4	109.493
Cl3	C1	H5	108.386	F4	C1	H5	110.223

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: B3LYP/6-311G**

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	-0.006
2	Br	0.005
3	Cl	-0.025
4	F	-0.176
5	H	0.201

	x	y	z	Total
	-0.083	0.017	1.362	1.365
CHELPG
AIM
ESP

	x	y	z
x	8.021	-0.332	0.067
y	-0.332	4.768	0.379
z	0.067	0.379	3.705

<r²>	183.473
(<r²>)^1/2	13.545