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	hartrees
Energy at 0K	-1158.215828
Energy at 298.15K	-1158.217195
HF Energy	-1158.215828
Nuclear repulsion energy	303.041627

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	1129	1079	358.08	1.46	0.71	0.83
2	A₁	680	650	16.01	4.68	0.00	0.00
3	A₁	460	439	0.51	7.80	0.22	0.36
4	A₁	264	252	0.02	3.87	0.64	0.78
5	A₂	327	312	0.00	1.59	0.75	0.86
6	B₁	910	869	439.26	3.76	0.75	0.86
7	B₁	441	421	0.22	4.82	0.75	0.86
8	B₂	1198	1144	271.18	0.38	0.75	0.86
9	B₂	442	422	0.66	2.11	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.346
F2	0.000	1.074	1.122
F3	0.000	-1.074	1.122
Cl4	1.471	0.000	-0.655
Cl5	-1.471	0.000	-0.655

	C1	F2	F3	Cl4	Cl5
C1		1.3250	1.3250	1.7790	1.7790
F2	1.3250		2.1474	2.5447	2.5447
F3	1.3250	2.1474		2.5447	2.5447
Cl4	1.7790	2.5447	2.5447		2.9410
Cl5	1.7790	2.5447	2.5447	2.9410

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	F3	108.258	F2	C1	Cl4	109.256
F2	C1	Cl5	109.256	F3	C1	Cl4	109.256
F3	C1	Cl5	109.256	Cl4	C1	Cl5	111.499

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)

using model chemistry: wB97X-D/TZVP

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	0.237
2	F	-0.107
3	F	-0.107
4	Cl	-0.012
5	Cl	-0.012

	x	y	z	Total
	0.000	0.000	-0.374	0.374
CHELPG
AIM
ESP

<r²>	157.468
(<r²>)^1/2	12.549

All results from a given calculation for CF2Cl2 (difluorodichloromethane)

using model chemistry: wB97X-D/TZVP

States and conformations

All results from a given calculation for CF₂Cl₂ (difluorodichloromethane)