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	hartrees
Energy at 0K	-1392.705050
Energy at 298.15K	-1392.707605
HF Energy	-1392.705050
Nuclear repulsion energy	619.235206

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1437	1302	0.00
2	A_g	1186	1075	0.00
3	A_g	774	701	0.00
4	A_g	483	438	0.00
5	A_g	393	356	0.00
6	A_g	274	249	0.00
7	A_u	1366	1238	405.54
8	A_u	411	372	0.67
9	A_u	245	222	1.62
10	A_u	76	69	0.25
11	B_g	1363	1235	0.00
12	B_g	597	541	0.00
13	B_g	356	323	0.00
14	B_u	1279	1159	425.76
15	B_u	927	840	433.23
16	B_u	670	607	14.58
17	B_u	477	432	1.81
18	B_u	181	164	1.19

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	0.737	0.000
C2	0.235	-0.737	0.000
Cl3	-1.983	0.842	0.000
Cl4	1.983	-0.842	0.000
F5	0.235	1.344	1.062
F6	0.235	1.344	-1.062
F7	-0.235	-1.344	1.062
F8	-0.235	-1.344	-1.062

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5478	1.7512	2.7233	1.3104	1.3104	2.3365	2.3365
C2	1.5478		2.7233	1.7512	2.3365	2.3365	1.3104	1.3104
Cl3	1.7512	2.7233		4.3093	2.5104	2.5104	2.9935	2.9935
Cl4	2.7233	1.7512	4.3093		2.9935	2.9935	2.5104	2.5104
F5	1.3104	2.3365	2.5104	2.9935		2.1239	2.7287	3.4578
F6	1.3104	2.3365	2.5104	2.9935	2.1239		3.4578	2.7287
F7	2.3365	1.3104	2.9935	2.5104	2.7287	3.4578		2.1239
F8	2.3365	1.3104	2.9935	2.5104	3.4578	2.7287	2.1239

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.127	C1	C2	F7	109.379
C1	C2	F8	109.379	C2	C1	Cl3	111.127
C2	C1	F5	109.379	C2	C1	F6	109.379
Cl3	C1	F5	109.319	Cl3	C1	F6	109.319
Cl4	C2	F7	109.319	Cl4	C2	F8	109.319
F5	C1	F6	108.266	F7	C2	F8	108.266

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: HF/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	0.483
2	C	0.483
3	Cl	-0.066
4	Cl	-0.066
5	F	-0.209
6	F	-0.209
7	F	-0.209
8	F	-0.209

	x	y	z
x	9.048	-0.679	0.000
y	-0.679	6.000	0.000
z	0.000	0.000	5.753

<r²>	307.362
(<r²>)^1/2	17.532

All results from a given calculation for CF2ClCF2Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)