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	hartrees
Energy at 0K	-1753.628672
Energy at 298.15K	-1753.630596
HF Energy	-1752.457330
Nuclear repulsion energy	703.091575

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	1281	1200	50.27
2	A	1245	1166	170.49
3	A	1166	1092	183.76
4	A	1111	1040	85.95
5	A	956	895	197.80
6	A	850	796	250.91
7	A	661	619	10.26
8	A	543	508	4.72
9	A	474	444	1.51
10	A	453	424	0.62
11	A	404	379	0.96
12	A	362	339	0.38
13	A	322	301	0.51
14	A	301	282	0.12
15	A	254	238	0.12
16	A	206	193	1.24
17	A	172	161	0.75
18	A	79	74	0.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.575	0.153	0.300
C2	-0.718	-0.519	-0.225
F3	0.451	0.244	1.650
Cl4	1.950	-0.876	-0.078
Cl5	0.776	1.759	-0.378
Cl6	-2.153	0.385	0.218
F7	-0.645	-0.642	-1.564
F8	-0.791	-1.753	0.312

	C1	C2	F3	Cl4	Cl5	Cl6	F7	F8
C1		1.5485	1.3591	1.7589	1.7543	2.7392	2.3647	2.3453
C2	1.5485		2.3376	2.6960	2.7278	1.7533	1.3465	1.3484
F3	1.3591	2.3376		2.5474	2.5522	2.9755	3.5093	2.7060
Cl4	1.7589	2.6960	2.5474		2.9000	4.3033	2.9992	2.9046
Cl5	1.7543	2.7278	2.5522	2.9000		3.2894	3.0308	3.9071
Cl6	2.7392	1.7533	2.9755	4.3033	3.2894		2.5507	2.5376
F7	2.3647	1.3465	3.5093	2.9992	3.0308	2.5507		2.1854
F8	2.3453	1.3484	2.7060	2.9046	3.9071	2.5376	2.1854

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	111.966	C1	C2	F7	109.339
C1	C2	F8	107.913	C2	C1	F3	106.837
C2	C1	Cl4	109.035	C2	C1	Cl5	111.212
F3	C1	Cl4	108.896	F3	C1	Cl5	109.466
Cl4	C1	Cl5	111.270	Cl6	C2	F7	110.052
Cl6	C2	F8	109.103	F7	C2	F8	108.378

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

using model chemistry: MP2/6-31G**

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

using model chemistry: MP2/6-31G**

States and conformations

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