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	hartrees
Energy at 0K	-1158.247785
Energy at 298.15K	-1158.248977
HF Energy	-1158.247785
Nuclear repulsion energy	300.844662

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	1049	1034	311.72	1.07	0.69	0.82
2	A₁	641	632	14.59	5.88	0.00	0.00
3	A₁	426	420	2.26	8.49	0.17	0.30
4	A₁	251	247	0.07	3.19	0.62	0.77
5	A₂	310	306	0.00	1.45	0.75	0.86
6	B₁	814	803	423.36	1.88	0.75	0.86
7	B₁	409	403	4.87	4.27	0.75	0.86
8	B₂	1118	1102	227.59	0.54	0.75	0.86
9	B₂	423	417	0.15	1.77	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.348
F2	0.000	1.085	1.132
F3	0.000	-1.085	1.132
Cl4	1.477	0.000	-0.661
Cl5	-1.477	0.000	-0.661

	C1	F2	F3	Cl4	Cl5
C1		1.3388	1.3388	1.7890	1.7890
F2	1.3388		2.1708	2.5642	2.5642
F3	1.3388	2.1708		2.5642	2.5642
Cl4	1.7890	2.5642	2.5642		2.9542
Cl5	1.7890	2.5642	2.5642	2.9542

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	108.336	F2	C1	Cl4	109.285
F2	C1	Cl5	109.285	F3	C1	Cl4	109.285
F3	C1	Cl5	109.285	Cl4	C1	Cl5	111.312

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: B97D3/cc-pVTZ

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	0.362
2	F	-0.105
3	F	-0.105
4	Cl	-0.076
5	Cl	-0.076

	x	y	z	Total
	0.000	0.000	-0.178	0.178
CHELPG
AIM
ESP

<r²>	158.895
(<r²>)^1/2	12.605

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: B97D3/cc-pVTZ

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)