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	hartrees
Energy at 0K	-3172.920796
Energy at 298.15K	-3172.925508
HF Energy	-3172.920796
Nuclear repulsion energy	321.672335

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	3196	3024	0.61	76.56	0.24	0.39
2	A	1356	1283	21.68	4.80	0.75	0.86
3	A	1244	1177	84.26	2.50	0.62	0.77
4	A	1146	1084	217.24	1.52	0.74	0.85
5	A	791	749	217.19	6.51	0.68	0.81
6	A	672	636	56.55	11.31	0.18	0.30
7	A	433	410	1.16	4.25	0.32	0.48
8	A	323	306	0.10	3.47	0.59	0.74
9	A	227	215	0.03	5.52	0.54	0.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.570	0.464	0.413
Br2	-1.204	-0.186	-0.028
Cl3	1.830	-0.682	-0.067
F4	0.776	1.635	-0.204
H5	0.614	0.600	1.487

	C1	Br2	Cl3	F4	H5
C1		1.9400	1.7699	1.3398	1.0838
Br2	1.9400		3.0745	2.6962	2.4936
Cl3	1.7699	3.0745		2.5495	2.3539
F4	1.3398	2.6962	2.5495		1.9898
H5	1.0838	2.4936	2.3539	1.9898

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.850	Br2	C1	F4	109.215
Br2	C1	H5	107.716	Cl3	C1	F4	109.358
Cl3	C1	H5	108.753	F4	C1	H5	109.924

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: M06-2X/TZVP

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	0.045
2	Br	-0.044
3	Cl	-0.031
4	F	-0.157
5	H	0.187

	x	y	z	Total
	-0.068	-0.123	1.384	1.391
CHELPG
AIM
ESP

	x	y	z
x	8.041	-0.183	0.115
y	-0.183	5.085	0.310
z	0.115	0.310	4.238

<r²>	180.170
(<r²>)^1/2	13.423