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	hartrees
Energy at 0K	-1144.890229
Energy at 298.15K	-1144.891007
HF Energy	-1144.890229
Nuclear repulsion energy	287.310043

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	1205	1205	190.97	1.12	0.75	0.86
2	A₁	630	630	30.22	6.49	0.01	0.01
3	A₁	410	410	0.30	7.56	0.25	0.40
4	A₁	218	218	1.36	4.17	0.66	0.80
5	A₂	272	272	0.00	2.15	0.75	0.86
6	B₁	828	828	308.23	3.18	0.75	0.86
7	B₁	390	390	0.44	4.83	0.75	0.86
8	B₂	1368	1368	142.30	0.29	0.75	0.86
9	B₂	383	383	7.53	2.22	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.413
F2	0.000	1.128	1.188
F3	0.000	-1.128	1.188
Cl4	1.546	0.000	-0.702
Cl5	-1.546	0.000	-0.702

	C1	F2	F3	Cl4	Cl5
C1		1.3685	1.3685	1.9056	1.9056
F2	1.3685		2.2552	2.6893	2.6893
F3	1.3685	2.2552		2.6893	2.6893
Cl4	1.9056	2.6893	2.6893		3.0916
Cl5	1.9056	2.6893	2.6893	3.0916

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	110.967	F2	C1	Cl4	109.352
F2	C1	Cl5	109.352	F3	C1	Cl4	109.352
F3	C1	Cl5	109.352	Cl4	C1	Cl5	108.425

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: TPSSh/STO-3G

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	0.283
2	F	-0.003
3	F	-0.003
4	Cl	-0.138
5	Cl	-0.138

	x	y	z	Total
	0.000	0.000	2.110	2.110
CHELPG
AIM
ESP

<r²>	170.706
(<r²>)^1/2	13.065

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: TPSSh/STO-3G

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)