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	hartrees
Energy at 0K	-1195.578469
Energy at 298.15K	-1195.578888
HF Energy	-1195.578469
Nuclear repulsion energy	350.698534

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1706	1688	17.71
2	A₁	1157	1145	297.52
3	A₁	556	551	2.14
4	A₁	318	315	2.04
5	A₁	161	159	1.11
6	A₂	508	502	0.00
7	A₂	140	139	0.00
8	B₁	339	335	0.16
9	B₂	1201	1188	28.35
10	B₂	931	921	149.84
11	B₂	417	413	0.03
12	B₂	405	401	0.25

Atom	y (Å)	z (Å)
C1	0.674	0.423
C2	-0.674	0.423
F3	1.341	1.573
F4	-1.341	1.573
Cl5	1.655	-0.982
Cl6	-1.655	-0.982

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3471	1.3293	2.3197	1.7137	2.7193
C2	1.3471		2.3197	1.3293	2.7193	1.7137
F3	1.3293	2.3197		2.6826	2.5738	3.9372
F4	2.3197	1.3293	2.6826		3.9372	2.5738
Cl5	1.7137	2.7193	2.5738	3.9372		3.3090
Cl6	2.7193	1.7137	3.9372	2.5738	3.3090

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.154	C1	C2	Cl6	124.918
C2	C1	F3	120.154	C2	C1	Cl5	124.918
F3	C1	Cl5	114.929	F4	C2	Cl6	114.929

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

using model chemistry: PBEPBE/6-31G(2df,p)

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	0.095
2	C	0.095
3	F	-0.019
4	F	-0.019
5	Cl	-0.076
6	Cl	-0.076

	x	y	z	Total
	0.000	0.000	-0.282	0.282
CHELPG
AIM
ESP

<r²>	238.293
(<r²>)^1/2	15.437