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	hartrees
Energy at 0K	-674.056187
Energy at 298.15K	-674.059058
HF Energy	-672.418991
Nuclear repulsion energy	465.969127

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_1g	1494	1411	0.00
2	A_1g	828	782	0.00
3	A_1g	356	336	0.00
4	A_1u	75	71	0.00
5	A_2u	1156	1092	255.85
6	A_2u	722	682	36.28
7	E_g	1290	1219	0.00
7	E_g	1290	1219	0.00
8	E_g	630	595	0.00
8	E_g	630	595	0.00
9	E_g	384	363	0.00
9	E_g	384	363	0.00
10	E_u	1315	1242	478.52
10	E_u	1315	1242	478.52
11	E_u	529	500	4.37
11	E_u	529	500	4.37
12	E_u	212	201	2.34
12	E_u	212	201	2.34

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.766
C2	0.000	0.000	-0.766
F3	0.000	1.248	1.208
F4	-1.080	-0.624	1.208
F5	1.080	-0.624	1.208
F6	0.000	-1.248	-1.208
F7	-1.080	0.624	-1.208
F8	1.080	0.624	-1.208

	C1	C2	F3	F4	F5	F6	F7	F8
C1		1.5318	1.3237	1.3237	1.3237	2.3354	2.3354	2.3354
C2	1.5318		2.3354	2.3354	2.3354	1.3237	1.3237	1.3237
F3	1.3237	2.3354		2.1610	2.1610	3.4736	2.7196	2.7196
F4	1.3237	2.3354	2.1610		2.1610	2.7196	2.7196	3.4736
F5	1.3237	2.3354	2.1610	2.1610		2.7196	3.4736	2.7196
F6	2.3354	1.3237	3.4736	2.7196	2.7196		2.1610	2.1610
F7	2.3354	1.3237	2.7196	2.7196	3.4736	2.1610		2.1610
F8	2.3354	1.3237	2.7196	3.4736	2.7196	2.1610	2.1610

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	109.522	C1	C2	F7	109.522
C1	C2	F8	109.522	C2	C1	F3	109.522
C2	C1	F4	109.522	C2	C1	F5	109.522
F3	C1	F4	109.420	F3	C1	F5	109.420
F4	C1	F5	109.420	F6	C2	F7	109.420
F6	C2	F8	109.420	F7	C2	F8	109.420

All results from a given calculation for C₂F₆ (hexafluoroethane)

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 C2F6 (hexafluoroethane)

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

States and conformations

All results from a given calculation for C₂F₆ (hexafluoroethane)