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	hartrees
Energy at 0K	-1394.619967
Energy at 298.15K	-1394.611572
HF Energy	-1392.417489
Nuclear repulsion energy	618.628033

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1451	1451	0.00
2	A_g	1201	1201	0.00
3	A_g	773	773	0.00
4	A_g	486	486	0.00
5	A_g	392	392	0.00
6	A_g	277	277	0.00
7	A_u	1381	1381	465.30
8	A_u	412	412	1.41
9	A_u	241	241	2.72
10	A_u	74	74	0.28
11	B_g	1376	1376	0.00
12	B_g	596	596	0.00
13	B_g	359	359	0.00
14	B_u	1284	1284	484.13
15	B_u	937	937	446.29
16	B_u	667	667	18.87
17	B_u	478	478	3.08
18	B_u	183	183	1.84

Atom	x (Å)	y (Å)	z (Å)
C1	-0.237	0.735	0.000
C2	0.237	-0.735	0.000
Cl3	-1.988	0.836	0.000
Cl4	1.988	-0.836	0.000
F5	0.237	1.338	1.067
F6	0.237	1.338	-1.067
F7	-0.237	-1.338	1.067
F8	-0.237	-1.338	-1.067

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5446	1.7546	2.7240	1.3139	1.3139	2.3320	2.3320
C2	1.5446		2.7240	1.7546	2.3320	2.3320	1.3139	1.3139
Cl3	1.7546	2.7240		4.3141	2.5181	2.5181	2.9894	2.9894
Cl4	2.7240	1.7546	4.3141		2.9894	2.9894	2.5181	2.5181
F5	1.3139	2.3320	2.5181	2.9894		2.1340	2.7184	3.4560
F6	1.3139	2.3320	2.5181	2.9894	2.1340		3.4560	2.7184
F7	2.3320	1.3139	2.9894	2.5181	2.7184	3.4560		2.1340
F8	2.3320	1.3139	2.9894	2.5181	3.4560	2.7184	2.1340

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.144	C1	C2	F7	109.070
C1	C2	F8	109.070	C2	C1	Cl3	111.144
C2	C1	F5	109.070	C2	C1	F6	109.070
Cl3	C1	F5	109.457	Cl3	C1	F6	109.457
Cl4	C2	F7	109.457	Cl4	C2	F8	109.457
F5	C1	F6	108.600	F7	C2	F8	108.600

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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