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	hartrees
Energy at 0K	-135.802503
Energy at 298.15K	-135.804976
HF Energy	-135.802503
Nuclear repulsion energy	242.255158

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1455	1306	0.00
2	A_g	1208	1085	0.00
3	A_g	768	689	0.00
4	A_g	485	435	0.00
5	A_g	389	349	0.00
6	A_g	271	244	0.00
7	A_u	1373	1233	498.25
8	A_u	405	364	1.29
9	A_u	241	217	2.61
10	A_u	73	66	0.30
11	B_g	1369	1229	0.00
12	B_g	588	528	0.00
13	B_g	351	315	0.00
14	B_u	1281	1151	481.27
15	B_u	937	841	416.44
16	B_u	660	593	20.27
17	B_u	475	426	4.46
18	B_u	179	161	1.52

Atom	x (Å)	y (Å)	z (Å)
C1	-0.239	0.744	0.000
C2	0.239	-0.744	0.000
Cl3	-1.999	0.847	0.000
Cl4	1.999	-0.847	0.000
F5	0.239	1.351	1.074
F6	0.239	1.351	-1.074
F7	-0.239	-1.351	1.074
F8	-0.239	-1.351	-1.074

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5635	1.7638	2.7463	1.3223	1.3223	2.3548	2.3548
C2	1.5635		2.7463	1.7638	2.3548	2.3548	1.3223	1.3223
Cl3	1.7638	2.7463		4.3431	2.5327	2.5327	3.0146	3.0146
Cl4	2.7463	1.7638	4.3431		3.0146	3.0146	2.5327	2.5327
F5	1.3223	2.3548	2.5327	3.0146		2.1471	2.7446	3.4846
F6	1.3223	2.3548	2.5327	3.0146	2.1471		3.4846	2.7446
F7	2.3548	1.3223	3.0146	2.5327	2.7446	3.4846		2.1471
F8	2.3548	1.3223	3.0146	2.5327	3.4846	2.7446	2.1471

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.116	C1	C2	F7	109.088
C1	C2	F8	109.088	C2	C1	Cl3	111.116
C2	C1	F5	109.088	C2	C1	F6	109.088
Cl3	C1	F5	109.473	Cl3	C1	F6	109.473
Cl4	C2	F7	109.473	Cl4	C2	F8	109.473
F5	C1	F6	108.558	F7	C2	F8	108.558

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

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	C	0.386
2	C	0.386
3	Cl	-0.053
4	Cl	-0.053
5	F	-0.167
6	F	-0.167
7	F	-0.167
8	F	-0.167

	x	y	z
x	8.657	-0.635	0.000
y	-0.635	4.852	0.000
z	0.000	0.000	4.366

<r²>	190.535
(<r²>)^1/2	13.803

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

using model chemistry: HF/CEP-31G*

States and conformations

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