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	hartrees
Energy at 0K	-1195.041418
Energy at 298.15K	-1195.042053
HF Energy	-1193.693695
Nuclear repulsion energy	354.649236

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1775	1689	19.52
2	A₁	1203	1145	312.44
3	A₁	587	558	0.10
4	A₁	332	316	2.27
5	A₁	170	162	1.01
6	A₂	581	552	0.00
7	A₂	152	144	0.00
8	B₁	355	338	0.29
9	B₂	1232	1172	20.73
10	B₂	990	942	153.53
11	B₂	445	423	0.54
12	B₂	424	404	0.53

Atom	y (Å)	z (Å)
C1	0.665	0.412
C2	-0.665	0.412
F3	1.326	1.561
F4	-1.326	1.561
Cl5	1.631	-0.972
Cl6	-1.631	-0.972

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3304	1.3250	2.2985	1.6877	2.6813
C2	1.3304		2.2985	1.3250	2.6813	1.6877
F3	1.3250	2.2985		2.6515	2.5508	3.8933
F4	2.2985	1.3250	2.6515		3.8933	2.5508
Cl5	1.6877	2.6813	2.5508	3.8933		3.2627
Cl6	2.6813	1.6877	3.8933	2.5508	3.2627

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.903	C1	C2	Cl6	124.923
C2	C1	F3	119.903	C2	C1	Cl5	124.923
F3	C1	Cl5	115.174	F4	C2	Cl6	115.174

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

using model chemistry: MP2=FULL/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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