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	hartrees
Energy at 0K	-1394.021635
Energy at 298.15K	-1394.023849
HF Energy	-1392.469353
Nuclear repulsion energy	616.706057

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1353	1278	0.00
2	A_g	1093	1033	0.00
3	A_g	722	682	0.00
4	A_g	454	429	0.00
5	A_g	368	347	0.00
6	A_g	260	246	0.00
7	A_u	1277	1206	314.11
8	A_u	381	360	0.68
9	A_u	220	208	1.31
10	A_u	74	70	0.07
11	B_g	1255	1185	0.00
12	B_g	554	523	0.00
13	B_g	327	309	0.00
14	B_u	1196	1130	329.83
15	B_u	866	818	367.54
16	B_u	619	585	11.84
17	B_u	445	420	1.04
18	B_u	170	160	1.28

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	0.735	0.000
C2	0.235	-0.735	0.000
Cl3	-1.994	0.793	0.000
Cl4	1.994	-0.793	0.000
F5	0.235	1.341	1.082
F6	0.235	1.341	-1.082
F7	-0.235	-1.341	1.082
F8	-0.235	-1.341	-1.082

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5427	1.7594	2.7022	1.3266	1.3266	2.3410	2.3410
C2	1.5427		2.7022	1.7594	2.3410	2.3410	1.3266	1.3266
Cl3	1.7594	2.7022		4.2912	2.5372	2.5372	2.9699	2.9699
Cl4	2.7022	1.7594	4.2912		2.9699	2.9699	2.5372	2.5372
F5	1.3266	2.3410	2.5372	2.9699		2.1640	2.7236	3.4786
F6	1.3266	2.3410	2.5372	2.9699	2.1640		3.4786	2.7236
F7	2.3410	1.3266	2.9699	2.5372	2.7236	3.4786		2.1640
F8	2.3410	1.3266	2.9699	2.5372	3.4786	2.7236	2.1640

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	109.661	C1	C2	F7	109.121
C1	C2	F8	109.121	C2	C1	Cl3	109.661
C2	C1	F5	109.121	C2	C1	F6	109.121
Cl3	C1	F5	109.812	Cl3	C1	F6	109.812
Cl4	C2	F7	109.812	Cl4	C2	F8	109.812
F5	C1	F6	109.295	F7	C2	F8	109.295

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: MP2/6-31G(2df,p)

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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All results from a given calculation for CF2ClCF2Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)