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	hartrees
Energy at 0K	-1189.955323
Energy at 298.15K	-1189.955857
HF Energy	-1189.717550
Nuclear repulsion energy	348.916660

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1756	1756	4.11
2	A₁	1165	1165	219.40
3	A₁	550	550	2.80
4	A₁	313	313	2.32
5	A₁	177	177	1.93
6	A₂	590	590	0.00
7	A₂	149	149	0.00
8	B₁	364	364	1.05
9	B₂	1216	1216	11.05
10	B₂	924	924	139.96
11	B₂	437	437	0.03
12	B₂	398	398	0.43

Atom	y (Å)	z (Å)
C1	0.666	0.422
C2	-0.666	0.422
F3	1.362	1.597
F4	-1.362	1.597
Cl5	1.634	-0.995
Cl6	-1.634	-0.995

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3316	1.3657	2.3436	1.7165	2.7015
C2	1.3316		2.3436	1.3657	2.7015	1.7165
F3	1.3657	2.3436		2.7240	2.6065	3.9619
F4	2.3436	1.3657	2.7240		3.9619	2.6065
Cl5	1.7165	2.7015	2.6065	3.9619		3.2682
Cl6	2.7015	1.7165	3.9619	2.6065	3.2682

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.648	C1	C2	Cl6	124.342
C2	C1	F3	120.648	C2	C1	Cl5	124.342
F3	C1	Cl5	115.010	F4	C2	Cl6	115.010

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

using model chemistry: B2PLYP=FULL/3-21G*

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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