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	hartrees
Energy at 0K	-1793.617286
Energy at 298.15K
HF Energy	-1793.617286
Nuclear repulsion energy	1459.630631

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	900	863	0.00
2	A₁	659	632	0.00
3	A₁	603	578	0.00
4	A₁	237	227	0.00
5	B₁	99	95	0.00
6	B₂	804	771	642.36
7	B₂	644	617	11.25
8	B₂	516	494	272.58
9	E₁	916	878	668.48
9	E₁	916	878	668.48
10	E₁	533	511	22.85
10	E₁	533	511	22.85
11	E₁	387	371	2.63
11	E₁	387	371	2.63
12	E₁	170	163	0.47
12	E₁	170	163	0.47
13	E₂	605	580	0.00
13	E₂	605	580	0.00
14	E₂	468	449	0.00
14	E₂	468	449	0.00
15	E₂	318	305	0.00
15	E₂	318	305	0.00
16	E₃	838	803	0.00
16	E₃	838	803	0.00
17	E₃	541	519	0.00
17	E₃	541	519	0.00
18	E₃	395	378	0.00
18	E₃	395	378	0.00
19	E₃	237	227	0.00
19	E₃	237	227	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.153
S2	0.000	0.000	-1.153
F3	0.000	1.604	1.153
F4	-1.604	0.000	1.153
F5	0.000	-1.604	1.153
F6	1.604	0.000	1.153
F7	0.000	0.000	2.737
F8	1.134	1.134	-1.153
F9	1.134	-1.134	-1.153
F10	-1.134	-1.134	-1.153
F11	-1.134	1.134	-1.153
F12	0.000	0.000	-2.737

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3056	1.6043	1.6043	1.6043	1.6043	1.5845	2.8092	2.8092	2.8092	2.8092	3.8901
S2	2.3056		2.8092	2.8092	2.8092	2.8092	3.8901	1.6043	1.6043	1.6043	1.6043	1.5845
F3	1.6043	2.8092		2.2688	3.2086	2.2688	2.2545	2.6130	3.7560	3.7560	2.6130	4.2083
F4	1.6043	2.8092	2.2688		2.2688	3.2086	2.2545	3.7560	3.7560	2.6130	2.6130	4.2083
F5	1.6043	2.8092	3.2086	2.2688		2.2688	2.2545	3.7560	2.6130	2.6130	3.7560	4.2083
F6	1.6043	2.8092	2.2688	3.2086	2.2688		2.2545	2.6130	2.6130	3.7560	3.7560	4.2083
F7	1.5845	3.8901	2.2545	2.2545	2.2545	2.2545		4.2083	4.2083	4.2083	4.2083	5.4745
F8	2.8092	1.6043	2.6130	3.7560	3.7560	2.6130	4.2083		2.2688	3.2086	2.2688	2.2545
F9	2.8092	1.6043	3.7560	3.7560	2.6130	2.6130	4.2083	2.2688		2.2688	3.2086	2.2545
F10	2.8092	1.6043	3.7560	2.6130	2.6130	3.7560	4.2083	3.2086	2.2688		2.2688	2.2545
F11	2.8092	1.6043	2.6130	2.6130	3.7560	3.7560	4.2083	2.2688	3.2086	2.2688		2.2545
F12	3.8901	1.5845	4.2083	4.2083	4.2083	4.2083	5.4745	2.2545	2.2545	2.2545	2.2545

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.018	S1	S2	F9	90.018
S1	S2	F10	90.018	S1	S2	F11	90.018
S1	S2	F12	180.000	S2	S1	F3	90.018
S2	S1	F4	90.018	S2	S1	F5	90.018
S2	S1	F6	90.018	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.964
F3	S1	F6	90.000	F3	S1	F7	89.982
F4	S1	F5	90.000	F4	S1	F6	179.964
F4	S1	F7	89.982	F5	S1	F6	90.000
F5	S1	F7	89.982	F6	S1	F7	89.982
F8	S2	F9	90.000	F8	S2	F10	179.964
F8	S2	F11	90.000	F8	S2	F12	89.982
F9	S2	F10	90.000	F9	S2	F11	179.964
F9	S2	F12	89.982	F10	S2	F11	90.000
F10	S2	F12	89.982	F11	S2	F12	89.982

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

using model chemistry: PBE1PBE/6-311G*

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	1.330
2	S	1.330
3	F	-0.271
4	F	-0.271
5	F	-0.271
6	F	-0.271
7	F	-0.245
8	F	-0.271
9	F	-0.271
10	F	-0.271
11	F	-0.271
12	F	-0.245

<r²>	507.332
(<r²>)^1/2	22.524

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

using model chemistry: PBE1PBE/6-311G*

States and conformations

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