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	hartrees
Energy at 0K	-1196.126554
Energy at 298.15K	-1196.126987
HF Energy	-1196.126554
Nuclear repulsion energy	345.005398

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1823	1739	6.33
2	A₁	1162	1108	270.62
3	A₁	540	515	1.94
4	A₁	306	292	2.76
5	A₁	153	146	2.06
6	A₂	577	550	0.00
7	A₂	147	140	0.00
8	B₁	343	327	1.98
9	B₂	1209	1153	9.35
10	B₂	929	886	159.65
11	B₂	425	405	0.04
12	B₂	393	375	1.01

Atom	y (Å)	z (Å)
C1	0.663	0.427
C2	-0.663	0.427
F3	1.348	1.604
F4	-1.348	1.604
Cl5	1.686	-1.000
Cl6	-1.686	-1.000

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3259	1.3625	2.3306	1.7557	2.7482
C2	1.3259		2.3306	1.3625	2.7482	1.7557
F3	1.3625	2.3306		2.6966	2.6264	3.9987
F4	2.3306	1.3625	2.6966		3.9987	2.6264
Cl5	1.7557	2.7482	2.6264	3.9987		3.3716
Cl6	2.7482	1.7557	3.9987	2.6264	3.3716

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.199	C1	C2	Cl6	125.634
C2	C1	F3	120.199	C2	C1	Cl5	125.634
F3	C1	Cl5	114.167	F4	C2	Cl6	114.167

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

using model chemistry: B1B95/6-31G

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	0.050
2	C	0.050
3	F	-0.264
4	F	-0.264
5	Cl	0.214
6	Cl	0.214

	x	y	z	Total
	0.000	0.000	-1.045	1.045
CHELPG
AIM
ESP

<r²>	246.248
(<r²>)^1/2	15.692