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	hartrees
Energy at 0K	-1181.894315
Energy at 298.15K	-1181.894420
HF Energy	-1181.894315
Nuclear repulsion energy	341.820326

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1834	1617	11.60
2	A₁	1284	1133	142.76
3	A₁	586	517	9.14
4	A₁	303	267	0.37
5	A₁	158	140	1.40
6	A₂	479	423	0.00
7	A₂	137	121	0.00
8	B₁	351	309	2.06
9	B₂	1412	1245	8.55
10	B₂	976	861	108.79
11	B₂	416	367	0.05
12	B₂	398	351	2.26

Atom	y (Å)	z (Å)
C1	0.682	0.488
C2	-0.682	0.488
F3	1.412	1.627
F4	-1.412	1.627
Cl5	1.637	-1.033
Cl6	-1.637	-1.033

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3633	1.3528	2.3831	1.7962	2.7728
C2	1.3633		2.3831	1.3528	2.7728	1.7962
F3	1.3528	2.3831		2.8236	2.6696	4.0458
F4	2.3831	1.3528	2.8236		4.0458	2.6696
Cl5	1.7962	2.7728	2.6696	4.0458		3.2731
Cl6	2.7728	1.7962	4.0458	2.6696	3.2731

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.667	C1	C2	Cl6	122.117
C2	C1	F3	122.667	C2	C1	Cl5	122.117
F3	C1	Cl5	115.217	F4	C2	Cl6	115.217

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

using model chemistry: PBE1PBE/STO-3G

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	0.103
2	C	0.103
3	F	-0.015
4	F	-0.015
5	Cl	-0.088
6	Cl	-0.088

	x	y	z	Total
	0.000	0.000	2.074	2.074
CHELPG
AIM
ESP

<r²>	245.798
(<r²>)^1/2	15.678