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	hartrees
Energy at 0K	-1393.408453
Energy at 298.15K	-1393.410876
HF Energy	-1392.431853
Nuclear repulsion energy	617.934807

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1433	1324	0.00
2	A_g	1194	1103	0.00
3	A_g	751	694	0.00
4	A_g	478	442	0.00
5	A_g	379	350	0.00
6	A_g	275	254	0.00
7	A_u	1348	1245	393.96
8	A_u	402	371	1.15
9	A_u	234	217	2.09
10	A_u	76	70	0.28
11	B_g	1340	1238	0.00
12	B_g	583	538	0.00
13	B_g	349	322	0.00
14	B_u	1262	1166	407.64
15	B_u	929	858	379.09
16	B_u	637	589	17.72
17	B_u	466	431	3.92
18	B_u	182	168	1.62

Atom	x (Å)	y (Å)	z (Å)
C1	-0.240	0.729	0.000
C2	0.240	-0.729	0.000
Cl3	-1.984	0.817	0.000
Cl4	1.984	-0.817	0.000
F5	0.240	1.337	1.079
F6	0.240	1.337	-1.079
F7	-0.240	-1.337	1.079
F8	-0.240	-1.337	-1.079

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5348	1.7462	2.7084	1.3283	1.3283	2.3304	2.3304
C2	1.5348		2.7084	1.7462	2.3304	2.3304	1.3283	1.3283
Cl3	1.7462	2.7084		4.2911	2.5260	2.5260	2.9738	2.9738
Cl4	2.7084	1.7462	4.2911		2.9738	2.9738	2.5260	2.5260
F5	1.3283	2.3304	2.5260	2.9738		2.1585	2.7158	3.4691
F6	1.3283	2.3304	2.5260	2.9738	2.1585		3.4691	2.7158
F7	2.3304	1.3283	2.9738	2.5260	2.7158	3.4691		2.1585
F8	2.3304	1.3283	2.9738	2.5260	3.4691	2.7158	2.1585

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.109	C1	C2	F7	108.755
C1	C2	F8	108.755	C2	C1	Cl3	111.109
C2	C1	F5	108.755	C2	C1	F6	108.755
Cl3	C1	F5	109.743	Cl3	C1	F6	109.743
Cl4	C2	F7	109.743	Cl4	C2	F8	109.743
F5	C1	F6	108.688	F7	C2	F8	108.688

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)