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	hartrees
Energy at 0K	-1193.636467
Energy at 298.15K	-1193.637384
HF Energy	-1193.636467
Nuclear repulsion energy	356.225216

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1977	1796	297.19
2	A₁	1141	1037	252.05
3	A₁	689	626	4.86
4	A₁	472	428	0.41
5	A₁	282	256	0.21
6	A₂	175	159	0.00
7	B₁	731	664	21.52
8	B₁	368	334	0.02
9	B₂	1489	1353	174.26
10	B₂	1078	979	132.31
11	B₂	503	457	0.82
12	B₂	205	186	3.28

Atom	y (Å)	z (Å)
C1	0.000	1.089
C2	0.000	-0.220
F3	1.064	1.815
F4	-1.064	1.815
Cl5	1.468	-1.114
Cl6	-1.468	-1.114

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3085	1.2881	1.2881	2.6470	2.6470
C2	1.3085		2.2961	2.2961	1.7189	1.7189
F3	1.2881	2.2961		2.1278	2.9565	3.8715
F4	1.2881	2.2961	2.1278		3.8715	2.9565
Cl5	2.6470	1.7189	2.9565	3.8715		2.9363
Cl6	2.6470	1.7189	3.8715	2.9565	2.9363

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	121.341	C1	C2	Cl6	121.341
C2	C1	F3	124.317	C2	C1	F4	124.317
F3	C1	F4	111.366	Cl5	C2	Cl6	117.318

All results from a given calculation for CF₂CCl₂ (difluorodichloroethylene)

using model chemistry: HF/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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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	0.744
2	C	-0.348
3	F	-0.220
4	F	-0.220
5	Cl	0.022
6	Cl	0.022

	x	y	z	Total
	0.000	0.000	0.339	0.339
CHELPG
AIM
ESP

<r²>	231.728
(<r²>)^1/2	15.223

All results from a given calculation for CF2CCl2 (difluorodichloroethylene)

using model chemistry: HF/6-311G**

States and conformations

All results from a given calculation for CF₂CCl₂ (difluorodichloroethylene)