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	hartrees
Energy at 0K	-3172.887016
Energy at 298.15K	-3172.891738
HF Energy	-3172.887016
Nuclear repulsion energy	322.109910

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	3198	3198	2.11	74.19	0.25	0.40
2	A	1357	1357	23.71	5.81	0.74	0.85
3	A	1252	1252	87.25	3.69	0.66	0.80
4	A	1156	1156	208.01	1.42	0.75	0.86
5	A	792	792	237.30	5.26	0.67	0.80
6	A	676	676	56.38	12.12	0.16	0.28
7	A	435	435	1.02	4.68	0.32	0.48
8	A	325	325	0.09	3.47	0.55	0.71
9	A	230	230	0.04	5.70	0.55	0.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.569	0.460	0.413
Br2	-1.203	-0.186	-0.028
Cl3	1.830	-0.679	-0.067
F4	0.774	1.631	-0.203
H5	0.613	0.593	1.488

	C1	Br2	Cl3	F4	H5
C1		1.9372	1.7654	1.3395	1.0841
Br2	1.9372		3.0729	2.6906	2.4909
Cl3	1.7654	3.0729		2.5432	2.3492
F4	1.3395	2.6906	2.5432		1.9914
H5	1.0841	2.4909	2.3492	1.9914

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.107	Br2	C1	F4	109.037
Br2	C1	H5	107.694	Cl3	C1	F4	109.226
Cl3	C1	H5	108.697	F4	C1	H5	110.061

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: M06-2X/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	-0.041
2	Br	0.016
3	Cl	-0.006
4	F	-0.186
5	H	0.217

	x	y	z	Total
	-0.071	-0.051	1.409	1.412
CHELPG
AIM
ESP

	x	y	z
x	7.703	-0.324	0.069
y	-0.324	4.626	0.388
z	0.069	0.388	3.666

<r²>	179.878
(<r²>)^1/2	13.412