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	hartrees
Energy at 0K	-1194.423494
Energy at 298.15K	-1194.424061
HF Energy	-1193.502726
Nuclear repulsion energy	350.989785

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1824	1732	11.69
2	A₁	1228	1166	286.67
3	A₁	579	550	0.35
4	A₁	337	320	2.70
5	A₁	171	163	1.30
6	A₂	538	511	0.00
7	A₂	152	144	0.00
8	B₁	350	333	1.70
9	B₂	1274	1210	16.82
10	B₂	991	941	166.58
11	B₂	442	420	0.20
12	B₂	424	403	1.19

Atom	y (Å)	z (Å)
C1	0.667	0.404
C2	-0.667	0.404
F3	1.320	1.571
F4	-1.320	1.571
Cl5	1.673	-0.974
Cl6	-1.673	-0.974

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3331	1.3384	2.3046	1.7062	2.7149
C2	1.3331		2.3046	1.3384	2.7149	1.7062
F3	1.3384	2.3046		2.6405	2.5701	3.9292
F4	2.3046	1.3384	2.6405		3.9292	2.5701
Cl5	1.7062	2.7149	2.5701	3.9292		3.3453
Cl6	2.7149	1.7062	3.9292	2.5701	3.3453

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.237	C1	C2	Cl6	126.134
C2	C1	F3	119.237	C2	C1	Cl5	126.134
F3	C1	Cl5	114.628	F4	C2	Cl6	114.628

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

using model chemistry: CCSD=FULL/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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