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	hartrees
Energy at 0K	-168.413022
Energy at 298.15K	-168.414784
Nuclear repulsion energy	86.462314

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3234	3108	8.58
2	A'	1296	1246	14.62
3	A'	1013	973	208.74
4	A'	676	650	53.72
5	A'	414	398	3.51
6	A'	257	247	0.45
7	A"	1240	1192	46.56
8	A"	727	699	244.75
9	A"	334	321	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	-0.187	0.541	0.000
H2	-1.083	1.158	0.000
F3	0.953	1.358	0.000
Cl4	-0.187	-0.489	1.525
Cl5	-0.187	-0.489	-1.525

	C1	H2	F3	Cl4	Cl5
C1		1.0870	1.4032	1.8404	1.8404
H2	1.0870		2.0457	2.4164	2.4164
F3	1.4032	2.0457		2.6532	2.6532
Cl4	1.8404	2.4164	2.6532		3.0503
Cl5	1.8404	2.4164	2.6532	3.0503

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.823	H2	C1	Cl4	108.514
H2	C1	Cl5	108.514	F3	C1	Cl4	109.021
F3	C1	Cl5	109.021	Cl4	C1	Cl5	111.928

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

using model chemistry: B3LYP/LANL2DZ

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	-0.196
2	H	0.315
3	F	-0.171
4	Cl	0.026
5	Cl	0.026

	x	y	z	Total
	-1.698	0.685	0.000	1.831
CHELPG
AIM
ESP

	x	y	z
x	1.976	0.286	0.000
y	0.286	3.368	0.000
z	0.000	0.000	5.911

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: B3LYP/LANL2DZ

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)