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	hartrees
Energy at 0K	-1158.369232
Energy at 298.15K	-1158.370567
HF Energy	-1158.369232
Nuclear repulsion energy	305.605209

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	1126	1126	309.77	1.38	0.75	0.85
2	A₁	677	677	14.21	6.00	0.01	0.01
3	A₁	460	460	0.23	6.27	0.18	0.31
4	A₁	259	259	0.04	2.35	0.64	0.78
5	A₂	320	320	0.00	1.17	0.75	0.86
6	B₁	905	905	405.32	2.78	0.75	0.86
7	B₁	438	438	0.06	3.33	0.75	0.86
8	B₂	1192	1192	220.47	0.88	0.75	0.86
9	B₂	437	437	0.24	1.21	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.336
F2	0.000	1.071	1.116
F3	0.000	-1.071	1.116
Cl4	1.451	0.000	-0.650
Cl5	-1.451	0.000	-0.650

	C1	F2	F3	Cl4	Cl5
C1		1.3252	1.3252	1.7549	1.7549
F2	1.3252		2.1425	2.5250	2.5250
F3	1.3252	2.1425		2.5250	2.5250
Cl4	1.7549	2.5250	2.5250		2.9023
Cl5	1.7549	2.5250	2.5250	2.9023

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	107.878	F2	C1	Cl4	109.331
F2	C1	Cl5	109.331	F3	C1	Cl4	109.331
F3	C1	Cl5	109.331	Cl4	C1	Cl5	111.563

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: B1B95/Def2TZVPP

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	0.308
2	F	-0.119
3	F	-0.119
4	Cl	-0.035
5	Cl	-0.035

	x	y	z	Total
	0.000	0.000	-0.450	0.450
CHELPG
AIM
ESP

<r²>	154.610
(<r²>)^1/2	12.434

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: B1B95/Def2TZVPP

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)