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	hartrees
Energy at 0K	-1754.009311
Energy at 298.15K	-1754.011202
HF Energy	-1752.497670
Nuclear repulsion energy	706.302932

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	1285	1213	43.44
2	A	1260	1190	174.05
3	A	1184	1118	149.96
4	A	1091	1030	88.48
5	A	935	883	165.47
6	A	836	789	248.71
7	A	670	633	10.32
8	A	544	514	3.16
9	A	472	446	1.21
10	A	452	427	0.33
11	A	402	380	0.49
12	A	358	338	0.34
13	A	320	303	0.48
14	A	293	277	0.08
15	A	247	234	0.11
16	A	200	189	0.82
17	A	168	158	0.60
18	A	77	73	0.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.567	0.155	0.315
C2	-0.711	-0.531	-0.234
F3	0.445	0.247	1.641
Cl4	1.951	-0.866	-0.070
Cl5	0.762	1.753	-0.382
Cl6	-2.147	0.374	0.225
F7	-0.635	-0.628	-1.553
F8	-0.782	-1.751	0.288

	C1	C2	F3	Cl4	Cl5	Cl6	F7	F8
C1		1.5506	1.3349	1.7616	1.7543	2.7249	2.3554	2.3352
C2	1.5506		2.3354	2.6876	2.7211	1.7587	1.3250	1.3292
F3	1.3349	2.3354		2.5365	2.5414	2.9559	3.4832	2.7071
Cl4	1.7616	2.6876	2.5365		2.8929	4.2917	2.9907	2.8946
Cl5	1.7543	2.7211	2.5414	2.8929		3.2755	2.9984	3.8870
Cl6	2.7249	1.7587	2.9559	4.2917	3.2755		2.5401	2.5272
F7	2.3554	1.3250	3.4832	2.9907	2.9984	2.5401		2.1616
F8	2.3352	1.3292	2.7071	2.8946	3.8870	2.5272	2.1616

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	110.696	C1	C2	F7	109.737
C1	C2	F8	108.123	C2	C1	F3	107.836
C2	C1	Cl4	108.303	C2	C1	Cl5	110.694
F3	C1	Cl4	109.231	F3	C1	Cl5	109.968
Cl4	C1	Cl5	110.738	Cl6	C2	F7	110.120
Cl6	C2	F8	109.064	F7	C2	F8	109.055

All results from a given calculation for CF₂ClCFCl₂ (Ethane, 1,1,2-trichloro-1,2,2-trifluoro-)

using model chemistry: MP2/6-31G(2df,p)

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 CF2ClCFCl2 (Ethane, 1,1,2-trichloro-1,2,2-trifluoro-)

using model chemistry: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for CF₂ClCFCl₂ (Ethane, 1,1,2-trichloro-1,2,2-trifluoro-)