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	hartrees
Energy at 0K	-1157.663868
Energy at 298.15K	-1157.665079
HF Energy	-1157.663868
Nuclear repulsion energy	300.495253

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	1059	1049	344.67	0.86	0.49	0.66
2	A₁	642	636	17.56	5.03	0.00	0.00
3	A₁	432	428	1.94	8.74	0.23	0.38
4	A₁	254	252	0.07	4.92	0.67	0.80
5	A₂	312	309	0.00	2.28	0.75	0.86
6	B₁	829	822	480.27	1.75	0.75	0.86
7	B₁	413	409	3.33	5.00	0.75	0.86
8	B₂	1133	1123	254.39	0.10	0.75	0.86
9	B₂	421	417	0.38	3.00	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.345
F2	0.000	1.088	1.130
F3	0.000	-1.088	1.130
Cl4	1.482	0.000	-0.659
Cl5	-1.482	0.000	-0.659

	C1	F2	F3	Cl4	Cl5
C1		1.3411	1.3411	1.7901	1.7901
F2	1.3411		2.1756	2.5649	2.5649
F3	1.3411	2.1756		2.5649	2.5649
Cl4	1.7901	2.5649	2.5649		2.9635
Cl5	1.7901	2.5649	2.5649	2.9635

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	108.411	F2	C1	Cl4	109.157
F2	C1	Cl5	109.157	F3	C1	Cl4	109.157
F3	C1	Cl5	109.157	Cl4	C1	Cl5	111.740

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: PBEPBE/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	0.221
2	F	-0.119
3	F	-0.119
4	Cl	0.009
5	Cl	0.009

	x	y	z	Total
	0.000	0.000	-0.162	0.162
CHELPG
AIM
ESP

<r²>	159.810
(<r²>)^1/2	12.642

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

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

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)