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	hartrees
Energy at 0K	-1196.241957
Energy at 298.15K	-1196.242497
HF Energy	-1196.241957
Nuclear repulsion energy	353.013206

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1816	1724	15.23
2	A₁	1227	1165	333.12
3	A₁	581	552	1.74
4	A₁	327	310	2.42
5	A₁	162	154	1.40
6	A₂	544	516	0.00
7	A₂	151	143	0.00
8	B₁	353	335	0.78
9	B₂	1276	1211	27.98
10	B₂	983	933	181.14
11	B₂	438	416	0.11
12	B₂	419	398	0.41

Atom	y (Å)	z (Å)
C1	0.666	0.412
C2	-0.666	0.412
F3	1.320	1.563
F4	-1.320	1.563
Cl5	1.654	-0.973
Cl6	-1.654	-0.973

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3310	1.3243	2.2953	1.7012	2.7011
C2	1.3310		2.2953	1.3243	2.7011	1.7012
F3	1.3243	2.2953		2.6406	2.5577	3.9082
F4	2.2953	1.3243	2.6406		3.9082	2.5577
Cl5	1.7012	2.7011	2.5577	3.9082		3.3071
Cl6	2.7011	1.7012	3.9082	2.5577	3.3071

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.634	C1	C2	Cl6	125.507
C2	C1	F3	119.634	C2	C1	Cl5	125.507
F3	C1	Cl5	114.859	F4	C2	Cl6	114.859

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	0.158
2	C	0.158
3	F	-0.234
4	F	-0.234
5	Cl	0.076
6	Cl	0.076

	x	y	z	Total
	0.000	0.000	-0.642	0.642
CHELPG
AIM
ESP

<r²>	235.917
(<r²>)^1/2	15.360