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	hartrees
Energy at 0K	-1154.916436
Energy at 298.15K	-1154.917725
HF Energy	-1154.916436
Nuclear repulsion energy	304.316322

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1099	1086	342.71
2	A₁	666	659	18.48
3	A₁	450	445	0.90
4	A₁	255	252	0.06
5	A₂	316	312	0.00
6	B₁	864	854	442.68
7	B₁	430	425	1.08
8	B₂	1170	1156	260.39
9	B₂	432	427	0.40

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.342
F2	0.000	1.072	1.118
F3	0.000	-1.072	1.118
Cl4	1.462	0.000	-0.652
Cl5	-1.462	0.000	-0.652

	C1	F2	F3	Cl4	Cl5
C1		1.3238	1.3238	1.7681	1.7681
F2	1.3238		2.1449	2.5343	2.5343
F3	1.3238	2.1449		2.5343	2.5343
Cl4	1.7681	2.5343	2.5343		2.9234
Cl5	1.7681	2.5343	2.5343	2.9234

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	108.221	F2	C1	Cl4	109.258
F2	C1	Cl5	109.258	F3	C1	Cl4	109.258
F3	C1	Cl5	109.258	Cl4	C1	Cl5	111.526

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: SVWN/TZVP

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	C	0.084
2	F	-0.069
3	F	-0.069
4	Cl	0.027
5	Cl	0.027

	x	y	z	Total
	0.000	0.000	-0.385	0.385
CHELPG
AIM
ESP

<r²>	156.369
(<r²>)^1/2	12.505

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: SVWN/TZVP

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)