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	hartrees
Energy at 0K	-3170.206901
Energy at 298.15K	-3170.211497
HF Energy	-3170.206901
Nuclear repulsion energy	315.328868

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	3242	3242	2.10	89.42	0.25	0.40
2	A	1329	1329	14.94	8.67	0.75	0.86
3	A	1251	1251	68.79	7.90	0.74	0.85
4	A	1077	1077	168.91	1.99	0.65	0.79
5	A	745	745	212.76	8.22	0.53	0.69
6	A	643	643	54.98	13.38	0.19	0.32
7	A	399	399	2.56	6.85	0.35	0.51
8	A	304	304	0.37	4.67	0.64	0.78
9	A	222	222	0.34	7.88	0.59	0.74

Atom	x (Å)	y (Å)	z (Å)
C1	0.560	0.479	0.432
Br2	-1.219	-0.196	-0.030
Cl3	1.868	-0.696	-0.069
F4	0.772	1.690	-0.210
H5	0.614	0.613	1.507

	C1	Br2	Cl3	F4	H5
C1		1.9586	1.8280	1.3869	1.0838
Br2	1.9586		3.1278	2.7486	2.5249
Cl3	1.8280	3.1278		2.6290	2.4016
F4	1.3869	2.7486	2.6290		2.0324
H5	1.0838	2.5249	2.4016	2.0324

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.336	Br2	C1	F4	109.298
Br2	C1	H5	108.743	Cl3	C1	F4	108.948
Cl3	C1	H5	108.413	F4	C1	H5	110.094

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: wB97X-D/6-31G

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	-0.253
2	Br	0.146
3	Cl	0.092
4	F	-0.266
5	H	0.281

	x	y	z	Total
	-0.383	-0.110	1.743	1.788
CHELPG
AIM
ESP

	x	y	z
x	7.160	-0.202	0.140
y	-0.202	3.925	0.389
z	0.140	0.389	2.687

<r²>	186.276
(<r²>)^1/2	13.648