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	hartrees
Energy at 0K	-1195.880015
Energy at 298.15K
HF Energy	-1195.517189
Nuclear repulsion energy	351.327917

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1763	1763	16.39
2	A₁	1175	1175	349.32
3	A₁	567	567	0.94
4	A₁	335	335	2.88
5	A₁	173	173	1.38
6	A₂	548	548	0.00
7	A₂	147	147	0.00
8	B₁	347	347	0.38
9	B₂	1215	1215	25.83
10	B₂	964	964	192.80
11	B₂	434	434	0.14
12	B₂	421	421	0.32

Atom	y (Å)	z (Å)
C1	0.667	0.414
C2	-0.667	0.414
F3	1.330	1.568
F4	-1.330	1.568
Cl5	1.663	-0.976
Cl6	-1.663	-0.976

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3340	1.3306	2.3062	1.7105	2.7134
C2	1.3340		2.3062	1.3306	2.7134	1.7105
F3	1.3306	2.3062		2.6598	2.5660	3.9283
F4	2.3062	1.3306	2.6598		3.9283	2.5660
Cl5	1.7105	2.7134	2.5660	3.9283		3.3261
Cl6	2.7134	1.7105	3.9283	2.5660	3.3261

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.881	C1	C2	Cl6	125.615
C2	C1	F3	119.881	C2	C1	Cl5	125.615
F3	C1	Cl5	114.504	F4	C2	Cl6	114.504

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

using model chemistry: B2PLYP=FULLultrafine/6-311G*

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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