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	hartrees
Energy at 0K	-698.632552
Energy at 298.15K	-698.634643
Nuclear repulsion energy	164.499213

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3064	3056	27.63
2	A'	1284	1281	78.10
3	A'	1049	1046	230.60
4	A'	727	725	186.81
5	A'	564	563	8.78
6	A'	374	373	2.50
7	A"	1341	1337	20.74
8	A"	1063	1060	247.27
9	A"	342	341	0.69

Atom	x (Å)	y (Å)	z (Å)
C1	-0.585	-0.099	0.000
H2	-1.464	0.553	0.000
Cl3	0.911	0.944	0.000
F4	-0.585	-0.889	1.104
F5	-0.585	-0.889	-1.104

	C1	H2	Cl3	F4	F5
C1		1.0948	1.8236	1.3574	1.3574
H2	1.0948		2.4072	2.0179	2.0179
Cl3	1.8236	2.4072		2.6109	2.6109
F4	1.3574	2.0179	2.6109		2.2073
F5	1.3574	2.0179	2.6109	2.2073

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	108.556	H2	C1	F4	110.292
H2	C1	Cl5	110.292	F3	C1	F4	109.449
F3	C1	Cl5	109.449	F4	C1	Cl5	108.787

All results from a given calculation for CHF₂Cl (difluorochloromethane)

using model chemistry: BLYP/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	0.179
2	H	0.229
3	Cl	-0.081
4	F	-0.164
5	F	-0.164

	x	y	z	Total
	-1.388	0.691	0.000	1.550
CHELPG
AIM
ESP

	x	y	z
x	3.997	1.196	0.000
y	1.196	3.476	0.000
z	0.000	0.000	2.695

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHF2Cl (difluorochloromethane)

using model chemistry: BLYP/6-311G*

States and conformations

All results from a given calculation for CHF₂Cl (difluorochloromethane)