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	hartrees
Energy at 0K	-1194.986104
Energy at 298.15K	-1194.986626
HF Energy	-1193.692651
Nuclear repulsion energy	351.629031

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1750	1692
2	A₁	1183	1144
3	A₁	567	548
4	A₁	328	317
5	A₁	166	161
6	A₂	532	515
7	A₂	147	142
8	B₁	335	324
9	B₂	1218	1177
10	B₂	966	934
11	B₂	431	417
12	B₂	415	401

Atom	y (Å)	z (Å)
C1	0.669	0.416
C2	-0.669	0.416
F3	1.334	1.570
F4	-1.334	1.570
Cl5	1.654	-0.978
Cl6	-1.654	-0.978

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3378	1.3320	2.3118	1.7062	2.7083
C2	1.3378		2.3118	1.3320	2.7083	1.7062
F3	1.3320	2.3118		2.6687	2.5672	3.9263
F4	2.3118	1.3320	2.6687		3.9263	2.5672
Cl5	1.7062	2.7083	2.5672	3.9263		3.3070
Cl6	2.7083	1.7062	3.9263	2.5672	3.3070

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.972	C1	C2	Cl6	125.247
C2	C1	F3	119.972	C2	C1	Cl5	125.247
F3	C1	Cl5	114.780	F4	C2	Cl6	114.780

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

using model chemistry: QCISD(T)/aug-cc-pVTZ

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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