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	hartrees
Energy at 0K	-1195.755120
Energy at 298.15K	-1195.755675
HF Energy	-1195.452980
Nuclear repulsion energy	350.425002

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1775	1702	15.57
2	A₁	1183	1134	331.57
3	A₁	569	545	0.74
4	A₁	328	314	2.44
5	A₁	169	162	1.32
6	A₂	549	526	0.00
7	A₂	148	142	0.00
8	B₁	353	338	0.43
9	B₂	1229	1178	28.73
10	B₂	962	922	183.15
11	B₂	432	414	0.08
12	B₂	416	399	0.32

Atom	y (Å)	z (Å)
C1	0.670	0.421
C2	-0.670	0.421
F3	1.340	1.574
F4	-1.340	1.574
Cl5	1.658	-0.982
Cl6	-1.658	-0.982

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3408	1.3337	2.3180	1.7156	2.7184
C2	1.3408		2.3180	1.3337	2.7184	1.7156
F3	1.3337	2.3180		2.6807	2.5757	3.9400
F4	2.3180	1.3337	2.6807		3.9400	2.5757
Cl5	1.7156	2.7184	2.5757	3.9400		3.3160
Cl6	2.7184	1.7156	3.9400	2.5757	3.3160

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.153	C1	C2	Cl6	125.146
C2	C1	F3	120.153	C2	C1	Cl5	125.146
F3	C1	Cl5	114.702	F4	C2	Cl6	114.702

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

using model chemistry: B2PLYP=FULL/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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