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	hartrees
Energy at 0K	-1194.577893
Energy at 298.15K	-1194.578390
HF Energy	-1193.586530
Nuclear repulsion energy	349.771792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1752	1698	13.79
2	A₁	1168	1132	314.49
3	A₁	572	554	0.02
4	A₁	329	319	2.25
5	A₁	164	159	0.96
6	A₂	507	492	0.00
7	A₂	148	143	0.00
8	B₁	332	322	0.34
9	B₂	1186	1149	13.05
10	B₂	967	937	162.34
11	B₂	431	417	0.70
12	B₂	412	400	0.50

Atom	y (Å)	z (Å)
C1	0.674	0.409
C2	-0.674	0.409
F3	1.340	1.579
F4	-1.340	1.579
Cl5	1.664	-0.981
Cl6	-1.664	-0.981

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3488	1.3462	2.3297	1.7064	2.7204
C2	1.3488		2.3297	1.3462	2.7204	1.7064
F3	1.3462	2.3297		2.6805	2.5805	3.9471
F4	2.3297	1.3462	2.6805		3.9471	2.5805
Cl5	1.7064	2.7204	2.5805	3.9471		3.3280
Cl6	2.7204	1.7064	3.9471	2.5805	3.3280

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.645	C1	C2	Cl6	125.446
C2	C1	F3	119.645	C2	C1	Cl5	125.446
F3	C1	Cl5	114.909	F4	C2	Cl6	114.909

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

using model chemistry: MP2=FULL/aug-cc-pVDZ

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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