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	hartrees
Energy at 0K	-1190.007079
Energy at 298.15K	-1190.007674
HF Energy	-1190.007079
Nuclear repulsion energy	351.108854

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1787	1716	4.61
2	A₁	1190	1142	239.51
3	A₁	566	544	2.71
4	A₁	315	302	2.11
5	A₁	180	173	1.88
6	A₂	613	588	0.00
7	A₂	150	144	0.00
8	B₁	373	358	0.51
9	B₂	1241	1191	12.61
10	B₂	942	905	144.81
11	B₂	443	425	0.11
12	B₂	404	387	0.31

Atom	y (Å)	z (Å)
C1	0.665	0.423
C2	-0.665	0.423
F3	1.359	1.588
F4	-1.359	1.588
Cl5	1.618	-0.990
Cl6	-1.618	-0.990

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3290	1.3568	2.3353	1.7045	2.6843
C2	1.3290		2.3353	1.3568	2.6843	1.7045
F3	1.3568	2.3353		2.7181	2.5915	3.9384
F4	2.3353	1.3568	2.7181		3.9384	2.5915
Cl5	1.7045	2.6843	2.5915	3.9384		3.2357
Cl6	2.6843	1.7045	3.9384	2.5915	3.2357

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.789	C1	C2	Cl6	124.008
C2	C1	F3	120.789	C2	C1	Cl5	124.008
F3	C1	Cl5	115.203	F4	C2	Cl6	115.203

All results from a given calculation for CFClCFCl (cis-1,2-dichloro-1,2-difluoroethylene)

using model chemistry: HSEh1PBE/3-21G*

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	0.124
2	C	0.124
3	F	-0.246
4	F	-0.246
5	Cl	0.122
6	Cl	0.122

	x	y	z	Total
	0.000	0.000	-0.903	0.903
CHELPG
AIM
ESP

<r²>	237.098
(<r²>)^1/2	15.398