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	hartrees
Energy at 0K	-673.642689
Energy at 298.15K	-673.645530
HF Energy	-672.380913
Nuclear repulsion energy	463.165833

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_1g	1524	1430	0.00
2	A_1g	829	779	0.00
3	A_1g	358	336	0.00
4	A_1u	67	63	0.00
5	A_2u	1173	1101	296.76
6	A_2u	719	675	43.68
7	E_g	1337	1255	0.00
7	E_g	1337	1255	0.00
8	E_g	631	592	0.00
8	E_g	631	592	0.00
9	E_g	385	362	0.00
9	E_g	385	362	0.00
10	E_u	1345	1262	518.70
10	E_u	1345	1262	518.70
11	E_u	525	493	6.63
11	E_u	525	493	6.63
12	E_u	216	202	3.03
12	E_u	216	202	3.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.766
C2	0.000	0.000	-0.766
F3	0.000	1.256	1.215
F4	-1.087	-0.628	1.215
F5	1.087	-0.628	1.215
F6	0.000	-1.256	-1.215
F7	-1.087	0.628	-1.215
F8	1.087	0.628	-1.215

	C1	C2	F3	F4	F5	F6	F7	F8
C1		1.5311	1.3337	1.3337	1.3337	2.3452	2.3452	2.3452
C2	1.5311		2.3452	2.3452	2.3452	1.3337	1.3337	1.3337
F3	1.3337	2.3452		2.1749	2.1749	3.4947	2.7355	2.7355
F4	1.3337	2.3452	2.1749		2.1749	2.7355	2.7355	3.4947
F5	1.3337	2.3452	2.1749	2.1749		2.7355	3.4947	2.7355
F6	2.3452	1.3337	3.4947	2.7355	2.7355		2.1749	2.1749
F7	2.3452	1.3337	2.7355	2.7355	3.4947	2.1749		2.1749
F8	2.3452	1.3337	2.7355	3.4947	2.7355	2.1749	2.1749

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	109.701	C1	C2	F7	109.701
C1	C2	F8	109.701	C2	C1	F3	109.701
C2	C1	F4	109.701	C2	C1	F5	109.701
F3	C1	F4	109.241	F3	C1	F5	109.241
F4	C1	F5	109.241	F6	C2	F7	109.241
F6	C2	F8	109.241	F7	C2	F8	109.241

All results from a given calculation for C₂F₆ (hexafluoroethane)

using model chemistry: MP3/6-31G*

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 C2F6 (hexafluoroethane)

using model chemistry: MP3/6-31G*

States and conformations

All results from a given calculation for C₂F₆ (hexafluoroethane)