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	hartrees
Energy at 0K	-503.508355
Energy at 298.15K	-503.509962
HF Energy	-502.788638
Nuclear repulsion energy	369.025687

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1204	1160	0.00
2	A_g	987	951	0.00
3	A_g	617	595	0.00
4	A_g	400	386	0.00
5	A_g	328	315	0.00
6	A_g	240	231	0.00
7	A_u	1053	1014	349.67
8	A_u	343	330	1.94
9	A_u	210	202	4.47
10	A_u	64	62	0.81
11	B_g	1033	995	0.00
12	B_g	499	480	0.00
13	B_g	294	284	0.00
14	B_u	1015	978	293.47
15	B_u	790	761	261.97
16	B_u	522	503	16.93
17	B_u	394	379	6.47
18	B_u	157	151	2.15

Atom	x (Å)	y (Å)	z (Å)
C1	-0.259	0.740	0.000
C2	0.259	-0.740	0.000
Cl3	-2.086	0.864	0.000
Cl4	2.086	-0.864	0.000
F5	0.259	1.404	1.143
F6	0.259	1.404	-1.143
F7	-0.259	-1.404	1.143
F8	-0.259	-1.404	-1.143

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5684	1.8304	2.8408	1.4199	1.4199	2.4296	2.4296
C2	1.5684		2.8408	1.8304	2.4296	2.4296	1.4199	1.4199
Cl3	1.8304	2.8408		4.5146	2.6640	2.6640	3.1277	3.1277
Cl4	2.8408	1.8304	4.5146		3.1277	3.1277	2.6640	2.6640
F5	1.4199	2.4296	2.6640	3.1277		2.2859	2.8553	3.6576
F6	1.4199	2.4296	2.6640	3.1277	2.2859		3.6576	2.8553
F7	2.4296	1.4199	3.1277	2.6640	2.8553	3.6576		2.2859
F8	2.4296	1.4199	3.1277	2.6640	3.6576	2.8553	2.2859

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	113.180	C1	C2	F7	108.686
C1	C2	F8	108.686	C2	C1	Cl3	113.180
C2	C1	F5	108.686	C2	C1	F6	108.686
Cl3	C1	F5	109.447	Cl3	C1	F6	109.447
Cl4	C2	F7	109.447	Cl4	C2	F8	109.447
F5	C1	F6	107.217	F7	C2	F8	107.217

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

using model chemistry: MP2/LANL2DZ

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/LANL2DZ

States and conformations

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