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	hartrees
Energy at 0K	-1394.385741
Energy at 298.15K	-1394.387941
HF Energy	-1392.702340
Nuclear repulsion energy	615.042415

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1313	1249	0.00
2	A_g	1079	1027	0.00
3	A_g	713	679	0.00
4	A_g	454	432	0.00
5	A_g	363	346	0.00
6	A_g	258	246	0.00
7	A_u	1224	1165	352.04
8	A_u	384	365	0.27
9	A_u	226	215	1.21
10	A_u	72	68	0.28
11	B_g	1207	1149	0.00
12	B_g	551	525	0.00
13	B_g	328	312	0.00
14	B_u	1163	1107	358.16
15	B_u	868	826	362.02
16	B_u	616	586	10.32
17	B_u	445	424	1.20
18	B_u	171	162	1.12

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	0.741	0.000
C2	0.235	-0.741	0.000
Cl3	-1.990	0.803	0.000
Cl4	1.990	-0.803	0.000
F5	0.235	1.352	1.086
F6	0.235	1.352	-1.086
F7	-0.235	-1.352	1.086
F8	-0.235	-1.352	-1.086

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5537	1.7562	2.7073	1.3318	1.3318	2.3575	2.3575
C2	1.5537		2.7073	1.7562	2.3575	2.3575	1.3318	1.3318
Cl3	1.7562	2.7073		4.2911	2.5357	2.5357	2.9835	2.9835
Cl4	2.7073	1.7562	4.2911		2.9835	2.9835	2.5357	2.5357
F5	1.3318	2.3575	2.5357	2.9835		2.1723	2.7440	3.4998
F6	1.3318	2.3575	2.5357	2.9835	2.1723		3.4998	2.7440
F7	2.3575	1.3318	2.9835	2.5357	2.7440	3.4998		2.1723
F8	2.3575	1.3318	2.9835	2.5357	3.4998	2.7440	2.1723

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	109.607	C1	C2	F7	109.332
C1	C2	F8	109.332	C2	C1	Cl3	109.607
C2	C1	F5	109.332	C2	C1	F6	109.332
Cl3	C1	F5	109.635	Cl3	C1	F6	109.635
Cl4	C2	F7	109.635	Cl4	C2	F8	109.635
F5	C1	F6	109.286	F7	C2	F8	109.286

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

using model chemistry: MP2/Def2TZVPP

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/Def2TZVPP

States and conformations

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