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	hartrees
Energy at 0K	-1058.969613
Energy at 298.15K	-1058.971399
Nuclear repulsion energy	206.405716

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3083	3075	9.30
2	A'	1303	1300	19.54
3	A'	1033	1030	208.93
4	A'	680	679	53.02
5	A'	426	425	2.36
6	A'	261	260	0.00
7	A"	1226	1222	63.83
8	A"	690	689	312.39
9	A"	343	342	1.92

Atom	x (Å)	y (Å)	z (Å)
C1	-0.179	0.534	0.000
H2	-1.088	1.138	0.000
F3	0.917	1.339	0.000
Cl4	-0.179	-0.482	1.503
Cl5	-0.179	-0.482	-1.503

	C1	H2	F3	Cl4	Cl5
C1		1.0917	1.3598	1.8140	1.8140
H2	1.0917		2.0146	2.3897	2.3897
F3	1.3598	2.0146		2.6029	2.6029
Cl4	1.8140	2.3897	2.6029		3.0063
Cl5	1.8140	2.3897	2.6029	3.0063

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.047	H2	C1	Cl4	108.067
H2	C1	Cl5	108.067	F3	C1	Cl4	109.360
F3	C1	Cl5	109.360	Cl4	C1	Cl5	111.916

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

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	-0.096
2	H	0.282
3	F	-0.151
4	Cl	-0.018
5	Cl	-0.018

	x	y	z	Total
	-1.176	0.780	0.000	1.411
CHELPG
AIM
ESP

	x	y	z
x	3.115	0.200	0.000
y	0.200	4.368	0.000
z	0.000	0.000	7.149

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: BLYP/6-311G*

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)