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	hartrees
Energy at 0K	-1392.854732
Energy at 298.15K	-1392.856814
HF Energy	-1392.212041
Nuclear repulsion energy	599.328616

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1345	1258	0.00
2	A_g	1109	1037	0.00
3	A_g	686	642	0.00
4	A_g	434	406	0.00
5	A_g	358	335	0.00
6	A_g	256	239	0.00
7	A_u	1266	1184	301.01
8	A_u	368	344	2.51
9	A_u	226	212	4.31
10	A_u	72	67	0.58
11	B_g	1262	1180	0.00
12	B_g	548	512	0.00
13	B_g	322	301	0.00
14	B_u	1174	1098	312.86
15	B_u	851	796	332.06
16	B_u	571	534	25.17
17	B_u	427	399	8.32
18	B_u	169	158	2.66

Atom	x (Å)	y (Å)	z (Å)
C1	-0.246	0.725	0.000
C2	0.246	-0.725	0.000
Cl3	-2.058	0.836	0.000
Cl4	2.058	-0.836	0.000
F5	0.246	1.362	1.118
F6	0.246	1.362	-1.118
F7	-0.246	-1.362	1.118
F8	-0.246	-1.362	-1.118

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5316	1.8159	2.7832	1.3779	1.3779	2.3685	2.3685
C2	1.5316		2.7832	1.8159	2.3685	2.3685	1.3779	1.3779
Cl3	1.8159	2.7832		4.4432	2.6148	2.6148	3.0609	3.0609
Cl4	2.7832	1.8159	4.4432		3.0609	3.0609	2.6148	2.6148
F5	1.3779	2.3685	2.6148	3.0609		2.2369	2.7690	3.5596
F6	1.3779	2.3685	2.6148	3.0609	2.2369		3.5596	2.7690
F7	2.3685	1.3779	3.0609	2.6148	2.7690	3.5596		2.2369
F8	2.3685	1.3779	3.0609	2.6148	3.5596	2.7690	2.2369

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	112.214	C1	C2	F7	108.871
C1	C2	F8	108.871	C2	C1	Cl3	112.214
C2	C1	F5	108.871	C2	C1	F6	108.871
Cl3	C1	F5	109.145	Cl3	C1	F6	109.145
Cl4	C2	F7	109.145	Cl4	C2	F8	109.145
F5	C1	F6	108.525	F7	C2	F8	108.525

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

using model chemistry: CID/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: CID/6-31G

States and conformations

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