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	hartrees
Energy at 0K	-698.456514
Energy at 298.15K	-698.458760
HF Energy	-698.456514
Nuclear repulsion energy	168.040055

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3206	3036	27.95
2	A'	1368	1295	101.62
3	A'	1185	1122	225.55
4	A'	814	770	169.16
5	A'	603	571	9.81
6	A'	413	391	0.16
7	A"	1434	1358	51.30
8	A"	1232	1167	195.82
9	A"	365	346	1.42

Atom	x (Å)	y (Å)	z (Å)
C1	-0.573	-0.086	0.000
H2	-1.449	0.561	0.000
Cl3	0.894	0.914	0.000
F4	-0.573	-0.866	1.083
F5	-0.573	-0.866	-1.083

	C1	H2	Cl3	F4	F5
C1		1.0894	1.7757	1.3345	1.3345
H2	1.0894		2.3694	1.9944	1.9944
Cl3	1.7757	2.3694		2.5485	2.5485
F4	1.3345	1.9944	2.5485		2.1659
F5	1.3345	1.9944	2.5485	2.1659

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.229	H2	C1	F4	110.326
H2	C1	Cl5	110.326	F3	C1	F4	109.226
F3	C1	Cl5	109.226	F4	C1	Cl5	108.484

All results from a given calculation for CHF₂Cl (difluorochloromethane)

using model chemistry: M06-2X/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	0.335
2	H	0.198
3	Cl	-0.034
4	F	-0.250
5	F	-0.250

	x	y	z	Total
	-1.320	0.751	0.000	1.519
CHELPG
AIM
ESP

	x	y	z
x	3.762	0.873	0.000
y	0.873	3.224	0.000
z	0.000	0.000	2.616

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHF2Cl (difluorochloromethane)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for CHF₂Cl (difluorochloromethane)