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	hartrees
Energy at 0K	-1194.383544
Energy at 298.15K	-1194.384113
HF Energy	-1193.502685
Nuclear repulsion energy	350.879655

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1830	1732	11.74
2	A₁	1233	1167	286.40
3	A₁	580	549	0.33
4	A₁	338	320	2.76
5	A₁	171	162	1.30
6	A₂	537	508	0.00
7	A₂	152	143	0.00
8	B₁	349	331	1.89
9	B₂	1281	1213	15.29
10	B₂	994	941	164.67
11	B₂	443	419	0.20
12	B₂	425	402	1.35

Atom	y (Å)	z (Å)
C1	0.667	0.403
C2	-0.667	0.403
F3	1.320	1.572
F4	-1.320	1.572
Cl5	1.674	-0.974
Cl6	-1.674	-0.974

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3333	1.3386	2.3045	1.7067	2.7162
C2	1.3333		2.3045	1.3386	2.7162	1.7067
F3	1.3386	2.3045		2.6393	2.5706	3.9302
F4	2.3045	1.3386	2.6393		3.9302	2.5706
Cl5	1.7067	2.7162	2.5706	3.9302		3.3488
Cl6	2.7162	1.7067	3.9302	2.5706	3.3488

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.198	C1	C2	Cl6	126.188
C2	C1	F3	119.198	C2	C1	Cl5	126.188
F3	C1	Cl5	114.613	F4	C2	Cl6	114.613

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

using model chemistry: CCD/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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