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	hartrees
Energy at 0K	-698.560713
Energy at 298.15K	-698.562808
Nuclear repulsion energy	164.247385

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3027	3032	27.80
2	A'	1240	1242	67.42
3	A'	1059	1061	219.37
4	A'	728	729	163.22
5	A'	564	565	7.26
6	A'	374	375	1.86
7	A"	1312	1314	28.35
8	A"	1085	1086	224.29
9	A"	339	339	0.71

Atom	x (Å)	y (Å)	z (Å)
C1	-0.585	-0.100	0.000
H2	-1.469	0.566	0.000
Cl3	0.912	0.946	0.000
F4	-0.585	-0.892	1.104
F5	-0.585	-0.892	-1.104

	C1	H2	Cl3	F4	F5
C1		1.1070	1.8257	1.3589	1.3589
H2	1.1070		2.4112	2.0314	2.0314
Cl3	1.8257	2.4112		2.6148	2.6148
F4	1.3589	2.0314	2.6148		2.2082
F5	1.3589	2.0314	2.6148	2.2082

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	108.090	H2	C1	F4	110.519
H2	C1	Cl5	110.519	F3	C1	F4	109.512
F3	C1	Cl5	109.512	F4	C1	Cl5	108.674

All results from a given calculation for CHF₂Cl (difluorochloromethane)

using model chemistry: BLYP/cc-pVDZ

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	0.306
2	H	0.055
3	Cl	-0.104
4	F	-0.129
5	F	-0.129

	x	y	z	Total
	-1.253	0.601	0.000	1.390
CHELPG
AIM
ESP

	x	y	z
x	3.822	1.041	0.000
y	1.041	3.363	0.000
z	0.000	0.000	2.681

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHF2Cl (difluorochloromethane)

using model chemistry: BLYP/cc-pVDZ

States and conformations

All results from a given calculation for CHF₂Cl (difluorochloromethane)