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	hartrees
Energy at 0K	-83.875236
Energy at 298.15K	-83.876469
HF Energy	-83.875236
Nuclear repulsion energy	99.371926

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	1093	1060	332.41	1.51	0.71	0.83
2	A₁	650	630	13.81	6.77	0.00	0.00
3	A₁	439	426	0.40	9.07	0.21	0.34
4	A₁	251	243	0.03	4.06	0.64	0.78
5	A₂	310	301	0.00	1.73	0.75	0.86
6	B₁	884	857	435.31	2.90	0.75	0.86
7	B₁	422	409	0.10	4.57	0.75	0.86
8	B₂	1158	1122	244.47	0.49	0.75	0.86
9	B₂	422	410	0.47	2.37	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.341
F2	0.000	1.090	1.135
F3	0.000	-1.090	1.135
Cl4	1.489	0.000	-0.661
Cl5	-1.489	0.000	-0.661

	C1	F2	F3	Cl4	Cl5
C1		1.3483	1.3483	1.7949	1.7949
F2	1.3483		2.1790	2.5751	2.5751
F3	1.3483	2.1790		2.5751	2.5751
Cl4	1.7949	2.5751	2.5751		2.9787
Cl5	1.7949	2.5751	2.5751	2.9787

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	107.819	F2	C1	Cl4	109.195
F2	C1	Cl5	109.195	F3	C1	Cl4	109.195
F3	C1	Cl5	109.195	Cl4	C1	Cl5	112.146

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: B3LYP/CEP-121G*

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	-0.150
3	F	-0.150
4	Cl	-0.031
5	Cl	-0.031

	x	y	z	Total
	0.000	0.000	-0.473	0.473
CHELPG
AIM
ESP

<r²>	96.607
(<r²>)^1/2	9.829

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: B3LYP/CEP-121G*

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)