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	hartrees
Energy at 0K	-1182.362064
Energy at 298.15K	-1182.362058
HF Energy	-1182.362064
Nuclear repulsion energy	338.986141

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1777	1586	11.90
2	A₁	1243	1109	137.17
3	A₁	563	503	9.49
4	A₁	296	265	0.40
5	A₁	154	137	1.34
6	A₂	451	403	0.00
7	A₂	133	119	0.00
8	B₁	338	302	1.64
9	B₂	1374	1226	7.73
10	B₂	944	842	108.00
11	B₂	403	360	0.12
12	B₂	386	345	2.02

Atom	y (Å)	z (Å)
C1	0.685	0.494
C2	-0.685	0.494
F3	1.421	1.639
F4	-1.421	1.639
Cl5	1.653	-1.042
Cl6	-1.653	-1.042

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3709	1.3610	2.3973	1.8153	2.7979
C2	1.3709		2.3973	1.3610	2.7979	1.8153
F3	1.3610	2.3973		2.8411	2.6912	4.0789
F4	2.3973	1.3610	2.8411		4.0789	2.6912
Cl5	1.8153	2.7979	2.6912	4.0789		3.3067
Cl6	2.7979	1.8153	4.0789	2.6912	3.3067

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.694	C1	C2	Cl6	122.222
C2	C1	F3	122.694	C2	C1	Cl5	122.222
F3	C1	Cl5	115.084	F4	C2	Cl6	115.084

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

using model chemistry: B3LYP/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	0.101
2	C	0.101
3	F	-0.013
4	F	-0.013
5	Cl	-0.089
6	Cl	-0.089

	x	y	z	Total
	0.000	0.000	2.097	2.097
CHELPG
AIM
ESP

<r²>	249.541
(<r²>)^1/2	15.797