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	hartrees
Energy at 0K	-1194.485700
Energy at 298.15K	-1194.486311
HF Energy	-1193.561663
Nuclear repulsion energy	350.260125

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1818	1739	16.23
2	A₁	1219	1166	307.74
3	A₁	577	552	0.19
4	A₁	334	319	2.70
5	A₁	171	164	1.38
6	A₂	565	540	0.00
7	A₂	150	144	0.00
8	B₁	359	343	1.20
9	B₂	1271	1216	24.72
10	B₂	982	940	175.22
11	B₂	438	419	0.23
12	B₂	422	404	0.89

Atom	y (Å)	z (Å)
C1	0.671	0.420
C2	-0.671	0.420
F3	1.340	1.573
F4	-1.340	1.573
Cl5	1.662	-0.981
Cl6	-1.662	-0.981

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3422	1.3326	2.3177	1.7166	2.7220
C2	1.3422		2.3177	1.3326	2.7220	1.7166
F3	1.3326	2.3177		2.6793	2.5746	3.9416
F4	2.3177	1.3326	2.6793		3.9416	2.5746
Cl5	1.7166	2.7220	2.5746	3.9416		3.3246
Cl6	2.7220	1.7166	3.9416	2.5746	3.3246

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.112	C1	C2	Cl6	125.270
C2	C1	F3	120.112	C2	C1	Cl5	125.270
F3	C1	Cl5	114.619	F4	C2	Cl6	114.619

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

using model chemistry: CCD/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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