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	hartrees
Energy at 0K	-1793.617098
Energy at 298.15K
HF Energy	-1793.617098
Nuclear repulsion energy	1419.961094

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	809	802	0.00
2	A₁	587	582	0.00
3	A₁	537	532	0.00
4	A₁	192	190	0.00
5	B₁	78	77	0.00
6	B₂	735	728	591.60
7	B₂	575	570	2.04
8	B₂	466	462	253.55
9	E₁	825	818	585.78
9	E₁	825	818	585.78
10	E₁	480	476	12.47
10	E₁	480	476	12.47
11	E₁	344	341	1.41
11	E₁	344	341	1.41
12	E₁	145	144	0.29
12	E₁	145	144	0.29
13	E₂	547	542	0.00
13	E₂	547	542	0.00
14	E₂	422	418	0.00
14	E₂	422	418	0.00
15	E₂	278	275	0.00
15	E₂	278	275	0.00
16	E₃	755	748	0.00
16	E₃	755	748	0.00
17	E₃	486	482	0.00
17	E₃	486	482	0.00
18	E₃	352	349	0.00
18	E₃	352	349	0.00
19	E₃	201	200	0.00
19	E₃	201	200	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.201
S2	0.000	0.000	-1.201
F3	0.000	1.644	1.195
F4	-1.644	0.000	1.195
F5	0.000	-1.644	1.195
F6	1.644	0.000	1.195
F7	0.000	0.000	2.817
F8	1.162	1.162	-1.195
F9	1.162	-1.162	-1.195
F10	-1.162	-1.162	-1.195
F11	-1.162	1.162	-1.195
F12	0.000	0.000	-2.817

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.4023	1.6437	1.6437	1.6437	1.6437	1.6155	2.9054	2.9054	2.9054	2.9054	4.0178
S2	2.4023		2.9054	2.9054	2.9054	2.9054	4.0178	1.6437	1.6437	1.6437	1.6437	1.6155
F3	1.6437	2.9054		2.3246	3.2874	2.3246	2.3093	2.7001	3.8642	3.8642	2.7001	4.3349
F4	1.6437	2.9054	2.3246		2.3246	3.2874	2.3093	3.8642	3.8642	2.7001	2.7001	4.3349
F5	1.6437	2.9054	3.2874	2.3246		2.3246	2.3093	3.8642	2.7001	2.7001	3.8642	4.3349
F6	1.6437	2.9054	2.3246	3.2874	2.3246		2.3093	2.7001	2.7001	3.8642	3.8642	4.3349
F7	1.6155	4.0178	2.3093	2.3093	2.3093	2.3093		4.3349	4.3349	4.3349	4.3349	5.6332
F8	2.9054	1.6437	2.7001	3.8642	3.8642	2.7001	4.3349		2.3246	3.2874	2.3246	2.3093
F9	2.9054	1.6437	3.8642	3.8642	2.7001	2.7001	4.3349	2.3246		2.3246	3.2874	2.3093
F10	2.9054	1.6437	3.8642	2.7001	2.7001	3.8642	4.3349	3.2874	2.3246		2.3246	2.3093
F11	2.9054	1.6437	2.7001	2.7001	3.8642	3.8642	4.3349	2.3246	3.2874	2.3246		2.3093
F12	4.0178	1.6155	4.3349	4.3349	4.3349	4.3349	5.6332	2.3093	2.3093	2.3093	2.3093

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	89.769	S1	S2	F9	89.769
S1	S2	F10	89.769	S1	S2	F11	89.769
S1	S2	F12	180.000	S2	S1	F3	89.769
S2	S1	F4	89.769	S2	S1	F5	89.769
S2	S1	F6	89.769	S2	S1	F7	180.000
F3	S1	F4	89.999	F3	S1	F5	179.539
F3	S1	F6	89.999	F3	S1	F7	90.231
F4	S1	F5	89.999	F4	S1	F6	179.539
F4	S1	F7	90.231	F5	S1	F6	89.999
F5	S1	F7	90.231	F6	S1	F7	90.231
F8	S2	F9	89.999	F8	S2	F10	179.539
F8	S2	F11	89.999	F8	S2	F12	90.231
F9	S2	F10	89.999	F9	S2	F11	179.539
F9	S2	F12	90.231	F10	S2	F11	89.999
F10	S2	F12	90.231	F11	S2	F12	90.231

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

using model chemistry: PBEPBE/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	1.196
2	S	1.196
3	F	-0.245
4	F	-0.245
5	F	-0.245
6	F	-0.245
7	F	-0.216
8	F	-0.245
9	F	-0.245
10	F	-0.245
11	F	-0.245
12	F	-0.216

<r²>	535.173
(<r²>)^1/2	23.134

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

using model chemistry: PBEPBE/6-311G**

States and conformations

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