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	hartrees
Energy at 0K	-1794.970981
Energy at 298.15K
HF Energy	-1794.970981
Nuclear repulsion energy	1433.495541

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	857	826	0.00
2	A₁	623	601	0.00
3	A₁	572	551	0.00
4	A₁	198	190	0.00
5	B₁	84	81	0.00
6	B₂	777	749	668.53
7	B₂	610	588	5.97
8	B₂	488	471	269.60
9	E₁	887	855	679.88
9	E₁	887	855	679.88
10	E₁	511	493	14.91
10	E₁	511	493	14.91
11	E₁	367	353	1.22
11	E₁	367	353	1.22
12	E₁	151	145	0.36
12	E₁	151	145	0.36
13	E₂	580	559	0.00
13	E₂	580	559	0.00
14	E₂	450	434	0.00
14	E₂	450	434	0.00
15	E₂	298	288	0.00
15	E₂	298	288	0.00
16	E₃	816	786	0.00
16	E₃	816	786	0.00
17	E₃	519	500	0.00
17	E₃	519	500	0.00
18	E₃	378	365	0.00
18	E₃	378	365	0.00
19	E₃	215	208	0.00
19	E₃	215	208	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.191
S2	0.000	0.000	-1.191
F3	0.000	1.624	1.193
F4	-1.624	0.000	1.193
F5	0.000	-1.624	1.193
F6	1.624	0.000	1.193
F7	0.000	0.000	2.795
F8	1.148	1.148	-1.193
F9	1.148	-1.148	-1.193
F10	-1.148	-1.148	-1.193
F11	-1.148	1.148	-1.193
F12	0.000	0.000	-2.795

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3822	1.6241	1.6241	1.6241	1.6241	1.6034	2.8846	2.8846	2.8846	2.8846	3.9856
S2	2.3822		2.8846	2.8846	2.8846	2.8846	3.9856	1.6241	1.6241	1.6241	1.6241	1.6034
F3	1.6241	2.8846		2.2968	3.2481	2.2968	2.2810	2.6901	3.8337	3.8337	2.6901	4.3054
F4	1.6241	2.8846	2.2968		2.2968	3.2481	2.2810	3.8337	3.8337	2.6901	2.6901	4.3054
F5	1.6241	2.8846	3.2481	2.2968		2.2968	2.2810	3.8337	2.6901	2.6901	3.8337	4.3054
F6	1.6241	2.8846	2.2968	3.2481	2.2968		2.2810	2.6901	2.6901	3.8337	3.8337	4.3054
F7	1.6034	3.9856	2.2810	2.2810	2.2810	2.2810		4.3054	4.3054	4.3054	4.3054	5.5890
F8	2.8846	1.6241	2.6901	3.8337	3.8337	2.6901	4.3054		2.2968	3.2481	2.2968	2.2810
F9	2.8846	1.6241	3.8337	3.8337	2.6901	2.6901	4.3054	2.2968		2.2968	3.2481	2.2810
F10	2.8846	1.6241	3.8337	2.6901	2.6901	3.8337	4.3054	3.2481	2.2968		2.2968	2.2810
F11	2.8846	1.6241	2.6901	2.6901	3.8337	3.8337	4.3054	2.2968	3.2481	2.2968		2.2810
F12	3.9856	1.6034	4.3054	4.3054	4.3054	4.3054	5.5890	2.2810	2.2810	2.2810	2.2810

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.062	S1	S2	F9	90.062
S1	S2	F10	90.062	S1	S2	F11	90.062
S1	S2	F12	180.000	S2	S1	F3	90.062
S2	S1	F4	90.062	S2	S1	F5	90.062
S2	S1	F6	90.062	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.876
F3	S1	F6	90.000	F3	S1	F7	89.938
F4	S1	F5	90.000	F4	S1	F6	179.876
F4	S1	F7	89.938	F5	S1	F6	90.000
F5	S1	F7	89.938	F6	S1	F7	89.938
F8	S2	F9	90.000	F8	S2	F10	179.876
F8	S2	F11	90.000	F8	S2	F12	89.938
F9	S2	F10	90.000	F9	S2	F11	179.876
F9	S2	F12	89.938	F10	S2	F11	90.000
F10	S2	F12	89.938	F11	S2	F12	89.938

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

using model chemistry: TPSSh/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	0.858
2	S	0.858
3	F	-0.172
4	F	-0.172
5	F	-0.172
6	F	-0.172
7	F	-0.169
8	F	-0.172
9	F	-0.172
10	F	-0.172
11	F	-0.172
12	F	-0.169

<r²>	527.043
(<r²>)^1/2	22.957

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

using model chemistry: TPSSh/TZVP

States and conformations

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