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	hartrees
Energy at 0K	-1392.606421
Energy at 298.15K	-1392.608986
HF Energy	-1392.606421
Nuclear repulsion energy	619.022794

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1451	1312	0.00
2	A_g	1199	1085	0.00
3	A_g	774	700	0.00
4	A_g	485	439	0.00
5	A_g	394	356	0.00
6	A_g	278	251	0.00
7	A_u	1369	1238	486.04
8	A_u	413	374	1.12
9	A_u	245	222	2.87
10	A_u	75	68	0.29
11	B_g	1365	1234	0.00
12	B_g	597	540	0.00
13	B_g	360	326	0.00
14	B_u	1280	1157	493.50
15	B_u	934	844	462.67
16	B_u	667	603	19.03
17	B_u	479	433	2.75
18	B_u	184	167	1.69

Atom	x (Å)	y (Å)	z (Å)
C1	-0.236	0.734	0.000
C2	0.236	-0.734	0.000
Cl3	-1.988	0.836	0.000
Cl4	1.988	-0.836	0.000
F5	0.236	1.336	1.066
F6	0.236	1.336	-1.066
F7	-0.236	-1.336	1.066
F8	-0.236	-1.336	-1.066

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5427	1.7552	2.7225	1.3113	1.3113	2.3284	2.3284
C2	1.5427		2.7225	1.7552	2.3284	2.3284	1.3113	1.3113
Cl3	1.7552	2.7225		4.3134	2.5159	2.5159	2.9873	2.9873
Cl4	2.7225	1.7552	4.3134		2.9873	2.9873	2.5159	2.5159
F5	1.3113	2.3284	2.5159	2.9873		2.1315	2.7128	3.4500
F6	1.3113	2.3284	2.5159	2.9873	2.1315		3.4500	2.7128
F7	2.3284	1.3113	2.9873	2.5159	2.7128	3.4500		2.1315
F8	2.3284	1.3113	2.9873	2.5159	3.4500	2.7128	2.1315

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.119	C1	C2	F7	109.073
C1	C2	F8	109.073	C2	C1	Cl3	111.119
C2	C1	F5	109.073	C2	C1	F6	109.073
Cl3	C1	F5	109.406	Cl3	C1	F6	109.406
Cl4	C2	F7	109.406	Cl4	C2	F8	109.406
F5	C1	F6	108.724	F7	C2	F8	108.724

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

using model chemistry: HF/6-311G*

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	0.519
2	C	0.519
3	Cl	-0.027
4	Cl	-0.027
5	F	-0.246
6	F	-0.246
7	F	-0.246
8	F	-0.246

	x	y	z
x	8.512	-0.709	0.000
y	-0.709	4.523	0.000
z	0.000	0.000	4.193

<r²>	308.035
(<r²>)^1/2	17.551

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

using model chemistry: HF/6-311G*

States and conformations

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