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	hartrees
Energy at 0K	-1195.688830
Energy at 298.15K	-1195.689432
HF Energy	-1195.688830
Nuclear repulsion energy	352.492113

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1810	1740	17.05
2	A₁	1210	1163	351.32
3	A₁	583	561	0.87
4	A₁	329	316	2.27
5	A₁	169	163	1.32
6	A₂	565	543	0.00
7	A₂	149	144	0.00
8	B₁	359	345	0.25
9	B₂	1258	1209	34.01
10	B₂	979	941	188.29
11	B₂	437	420	0.12
12	B₂	422	405	0.24

Atom	y (Å)	z (Å)
C1	0.668	0.420
C2	-0.668	0.420
F3	1.336	1.565
F4	-1.336	1.565
Cl5	1.645	-0.977
Cl6	-1.645	-0.977

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3360	1.3251	2.3078	1.7052	2.7026
C2	1.3360		2.3078	1.3251	2.7026	1.7052
F3	1.3251	2.3078		2.6722	2.5604	3.9178
F4	2.3078	1.3251	2.6722		3.9178	2.5604
Cl5	1.7052	2.7026	2.5604	3.9178		3.2907
Cl6	2.7026	1.7052	3.9178	2.5604	3.2907

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.278	C1	C2	Cl6	124.972
C2	C1	F3	120.278	C2	C1	Cl5	124.972
F3	C1	Cl5	114.750	F4	C2	Cl6	114.750

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

using model chemistry: PBE1PBE/cc-pVDZ

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	0.133
2	C	0.133
3	F	-0.127
4	F	-0.127
5	Cl	-0.006
6	Cl	-0.006

	x	y	z	Total
	0.000	0.000	-0.683	0.683
CHELPG
AIM
ESP

<r²>	236.411
(<r²>)^1/2	15.376