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	hartrees
Energy at 0K	-1182.347778
Energy at 298.15K	-1182.347882
HF Energy	-1182.347778
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1831	1831	10.61
2	A₁	1271	1271	139.36
3	A₁	577	577	9.10
4	A₁	303	303	0.41
5	A₁	159	159	1.46
6	A₂	486	486	0.00
7	A₂	138	138	0.00
8	B₁	353	353	2.57
9	B₂	1396	1396	8.52
10	B₂	968	968	109.66
11	B₂	415	415	0.12
12	B₂	397	397	2.01

Atom	y (Å)	z (Å)
C1	0.682	0.485
C2	-0.682	0.485
F3	1.409	1.631
F4	-1.409	1.631
Cl5	1.650	-1.034
Cl6	-1.650	-1.034

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3632	1.3569	2.3837	1.8015	2.7826
C2	1.3632		2.3837	1.3569	2.7826	1.8015
F3	1.3569	2.3837		2.8174	2.6759	4.0565
F4	2.3837	1.3569	2.8174		4.0565	2.6759
Cl5	1.8015	2.7826	2.6759	4.0565		3.2992
Cl6	2.7826	1.8015	4.0565	2.6759	3.2992

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.401	C1	C2	Cl6	122.502
C2	C1	F3	122.401	C2	C1	Cl5	122.502
F3	C1	Cl5	115.097	F4	C2	Cl6	115.097

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

using model chemistry: wB97X-D/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	0.107
2	C	0.107
3	F	-0.021
4	F	-0.021
5	Cl	-0.086
6	Cl	-0.086

	x	y	z	Total
	0.000	0.000	1.994	1.994
CHELPG
AIM
ESP

<r²>	247.434
(<r²>)^1/2	15.730