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	hartrees
Energy at 0K	-1793.884917
Energy at 298.15K
HF Energy	-1793.884917
Nuclear repulsion energy	1449.852066

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	892	857	0.00
2	A₁	656	630	0.00
3	A₁	600	576	0.00
4	A₁	223	214	0.00
5	B₁	92	88	0.00
6	B₂	804	772	681.79
7	B₂	641	615	9.29
8	B₂	513	492	264.16
9	E₁	927	890	705.78
9	E₁	927	890	705.78
10	E₁	536	514	18.08
10	E₁	536	514	18.08
11	E₁	387	372	1.67
11	E₁	387	372	1.67
12	E₁	164	158	0.45
12	E₁	164	158	0.45
13	E₂	606	582	0.00
13	E₂	606	582	0.00
14	E₂	472	454	0.00
14	E₂	472	454	0.00
15	E₂	316	303	0.00
15	E₂	316	303	0.00
16	E₃	854	820	0.00
16	E₃	854	820	0.00
17	E₃	544	522	0.00
17	E₃	544	522	0.00
18	E₃	398	382	0.00
18	E₃	398	382	0.00
19	E₃	231	222	0.00
19	E₃	231	222	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.169
S2	0.000	0.000	-1.169
F3	0.000	1.609	1.173
F4	-1.609	0.000	1.173
F5	0.000	-1.609	1.173
F6	1.609	0.000	1.173
F7	0.000	0.000	2.761
F8	1.138	1.138	-1.173
F9	1.138	-1.138	-1.173
F10	-1.138	-1.138	-1.173
F11	-1.138	1.138	-1.173
F12	0.000	0.000	-2.761

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3379	1.6091	1.6091	1.6091	1.6091	1.5921	2.8417	2.8417	2.8417	2.8417	3.9299
S2	2.3379		2.8417	2.8417	2.8417	2.8417	3.9299	1.6091	1.6091	1.6091	1.6091	1.5921
F3	1.6091	2.8417		2.2756	3.2182	2.2756	2.2605	2.6501	3.7877	3.7877	2.6501	4.2506
F4	1.6091	2.8417	2.2756		2.2756	3.2182	2.2605	3.7877	3.7877	2.6501	2.6501	4.2506
F5	1.6091	2.8417	3.2182	2.2756		2.2756	2.2605	3.7877	2.6501	2.6501	3.7877	4.2506
F6	1.6091	2.8417	2.2756	3.2182	2.2756		2.2605	2.6501	2.6501	3.7877	3.7877	4.2506
F7	1.5921	3.9299	2.2605	2.2605	2.2605	2.2605		4.2506	4.2506	4.2506	4.2506	5.5220
F8	2.8417	1.6091	2.6501	3.7877	3.7877	2.6501	4.2506		2.2756	3.2182	2.2756	2.2605
F9	2.8417	1.6091	3.7877	3.7877	2.6501	2.6501	4.2506	2.2756		2.2756	3.2182	2.2605
F10	2.8417	1.6091	3.7877	2.6501	2.6501	3.7877	4.2506	3.2182	2.2756		2.2756	2.2605
F11	2.8417	1.6091	2.6501	2.6501	3.7877	3.7877	4.2506	2.2756	3.2182	2.2756		2.2605
F12	3.9299	1.5921	4.2506	4.2506	4.2506	4.2506	5.5220	2.2605	2.2605	2.2605	2.2605

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.155	S1	S2	F9	90.155
S1	S2	F10	90.155	S1	S2	F11	90.155
S1	S2	F12	180.000	S2	S1	F3	90.155
S2	S1	F4	90.155	S2	S1	F5	90.155
S2	S1	F6	90.155	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.689
F3	S1	F6	90.000	F3	S1	F7	89.845
F4	S1	F5	90.000	F4	S1	F6	179.689
F4	S1	F7	89.845	F5	S1	F6	90.000
F5	S1	F7	89.845	F6	S1	F7	89.845
F8	S2	F9	90.000	F8	S2	F10	179.689
F8	S2	F11	90.000	F8	S2	F12	89.845
F9	S2	F10	90.000	F9	S2	F11	179.689
F9	S2	F12	89.845	F10	S2	F11	90.000
F10	S2	F12	89.845	F11	S2	F12	89.845

All results from a given calculation for S₂F₁₀ (disulphur decafluoride)

using model chemistry: HSEh1PBE/TZVP

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	S	0.864
2	S	0.864
3	F	-0.172
4	F	-0.172
5	F	-0.172
6	F	-0.172
7	F	-0.174
8	F	-0.172
9	F	-0.172
10	F	-0.172
11	F	-0.172
12	F	-0.174

<r²>	515.226
(<r²>)^1/2	22.699

All results from a given calculation for S2F10 (disulphur decafluoride)

using model chemistry: HSEh1PBE/TZVP

States and conformations

All results from a given calculation for S₂F₁₀ (disulphur decafluoride)