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	hartrees
Energy at 0K	-1393.634116
Energy at 298.15K	-1393.636308
HF Energy	-1392.428713
Nuclear repulsion energy	613.250974

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1352	1275	0.00
2	A_g	1120	1056	0.00
3	A_g	712	671	0.00
4	A_g	456	430	0.00
5	A_g	360	340	0.00
6	A_g	265	250	0.00
7	A_u	1256	1184	356.89
8	A_u	385	363	0.81
9	A_u	224	211	1.76
10	A_u	73	69	0.24
11	B_g	1245	1174	0.00
12	B_g	556	525	0.00
13	B_g	333	314	0.00
14	B_u	1183	1116	366.24
15	B_u	885	834	364.48
16	B_u	603	569	14.56
17	B_u	444	419	2.04
18	B_u	175	165	1.55

Atom	x (Å)	y (Å)	z (Å)
C1	-0.237	0.736	0.000
C2	0.237	-0.736	0.000
Cl3	-1.999	0.788	0.000
Cl4	1.999	-0.788	0.000
F5	0.237	1.346	1.097
F6	0.237	1.346	-1.097
F7	-0.237	-1.346	1.097
F8	-0.237	-1.346	-1.097

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5459	1.7623	2.7059	1.3417	1.3417	2.3526	2.3526
C2	1.5459		2.7059	1.7623	2.3526	2.3526	1.3417	1.3417
Cl3	1.7623	2.7059		4.2971	2.5521	2.5521	2.9764	2.9764
Cl4	2.7059	1.7623	4.2971		2.9764	2.9764	2.5521	2.5521
F5	1.3417	2.3526	2.5521	2.9764		2.1937	2.7326	3.5042
F6	1.3417	2.3526	2.5521	2.9764	2.1937		3.5042	2.7326
F7	2.3526	1.3417	2.9764	2.5521	2.7326	3.5042		2.1937
F8	2.3526	1.3417	2.9764	2.5521	3.5042	2.7326	2.1937

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	109.584	C1	C2	F7	108.911
C1	C2	F8	108.911	C2	C1	Cl3	109.584
C2	C1	F5	108.911	C2	C1	F6	108.911
Cl3	C1	F5	109.871	Cl3	C1	F6	109.871
Cl4	C2	F7	109.871	Cl4	C2	F8	109.871
F5	C1	F6	109.670	F7	C2	F8	109.670

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

using model chemistry: MP2/6-31G*

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*

States and conformations

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