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	hartrees
Energy at 0K	-1196.035396
Energy at 298.15K	-1196.035942
HF Energy	-1196.035396
Nuclear repulsion energy	351.446521

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1777	1706	15.70
2	A₁	1183	1136	370.62
3	A₁	575	552	0.88
4	A₁	332	319	2.50
5	A₁	168	162	1.09
6	A₂	551	529	0.00
7	A₂	147	141	0.00
8	B₁	345	331	0.33
9	B₂	1221	1172	28.96
10	B₂	971	932	182.47
11	B₂	435	418	0.15
12	B₂	419	402	0.47

Atom	y (Å)	z (Å)
C1	0.668	0.408
C2	-0.668	0.408
F3	1.329	1.567
F4	-1.329	1.567
Cl5	1.666	-0.973
Cl6	-1.666	-0.973

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3367	1.3334	2.3089	1.7044	2.7128
C2	1.3367		2.3089	1.3334	2.7128	1.7044
F3	1.3334	2.3089		2.6582	2.5622	3.9272
F4	2.3089	1.3334	2.6582		3.9272	2.5622
Cl5	1.7044	2.7128	2.5622	3.9272		3.3322
Cl6	2.7128	1.7044	3.9272	2.5622	3.3322

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.708	C1	C2	Cl6	125.832
C2	C1	F3	119.708	C2	C1	Cl5	125.832
F3	C1	Cl5	114.461	F4	C2	Cl6	114.461

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

using model chemistry: B3PW91/6-31+G**

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	-0.001
2	C	-0.001
3	F	-0.216
4	F	-0.216
5	Cl	0.217
6	Cl	0.217

	x	y	z	Total
	0.000	0.000	-1.067	1.067
CHELPG
AIM
ESP

<r²>	238.630
(<r²>)^1/2	15.448