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	hartrees
Energy at 0K	-1794.289192
Energy at 298.15K
HF Energy	-1794.289192
Nuclear repulsion energy	1457.883421

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	918	875	0.00
2	A₁	685	652	0.00
3	A₁	613	584	0.00
4	A₁	265	252	0.00
5	B₁	122	116	0.00
6	B₂	826	786	659.69
7	B₂	664	633	7.85
8	B₂	517	492	272.13
9	E₁	949	904	698.36
9	E₁	949	904	698.36
10	E₁	535	510	20.31
10	E₁	535	510	20.31
11	E₁	403	383	2.24
11	E₁	403	383	2.24
12	E₁	195	186	0.21
12	E₁	195	186	0.21
13	E₂	625	595	0.00
13	E₂	625	595	0.00
14	E₂	474	451	0.00
14	E₂	474	451	0.00
15	E₂	334	318	0.00
15	E₂	334	318	0.00
16	E₃	876	835	0.00
16	E₃	876	835	0.00
17	E₃	543	517	0.00
17	E₃	543	517	0.00
18	E₃	396	377	0.00
18	E₃	396	377	0.00
19	E₃	247	235	0.00
19	E₃	247	235	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	1.605	1.158
F4	-1.605	0.000	1.158
F5	0.000	-1.605	1.158
F6	1.605	0.000	1.158
F7	0.000	0.000	2.743
F8	1.135	1.135	-1.158
F9	1.135	-1.135	-1.158
F10	-1.135	-1.135	-1.158
F11	-1.135	1.135	-1.158
F12	0.000	0.000	-2.743

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3051	1.6047	1.6047	1.6047	1.6047	1.5900	2.8136	2.8136	2.8136	2.8136	3.8951
S2	2.3051		2.8136	2.8136	2.8136	2.8136	3.8951	1.6047	1.6047	1.6047	1.6047	1.5900
F3	1.6047	2.8136		2.2694	3.2095	2.2694	2.2549	2.6223	3.7630	3.7630	2.6223	4.2182
F4	1.6047	2.8136	2.2694		2.2694	3.2095	2.2549	3.7630	3.7630	2.6223	2.6223	4.2182
F5	1.6047	2.8136	3.2095	2.2694		2.2694	2.2549	3.7630	2.6223	2.6223	3.7630	4.2182
F6	1.6047	2.8136	2.2694	3.2095	2.2694		2.2549	2.6223	2.6223	3.7630	3.7630	4.2182
F7	1.5900	3.8951	2.2549	2.2549	2.2549	2.2549		4.2182	4.2182	4.2182	4.2182	5.4851
F8	2.8136	1.6047	2.6223	3.7630	3.7630	2.6223	4.2182		2.2694	3.2095	2.2694	2.2549
F9	2.8136	1.6047	3.7630	3.7630	2.6223	2.6223	4.2182	2.2694		2.2694	3.2095	2.2549
F10	2.8136	1.6047	3.7630	2.6223	2.6223	3.7630	4.2182	3.2095	2.2694		2.2694	2.2549
F11	2.8136	1.6047	2.6223	2.6223	3.7630	3.7630	4.2182	2.2694	3.2095	2.2694		2.2549
F12	3.8951	1.5900	4.2182	4.2182	4.2182	4.2182	5.4851	2.2549	2.2549	2.2549	2.2549

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.211	S1	S2	F9	90.211
S1	S2	F10	90.211	S1	S2	F11	90.211
S1	S2	F12	180.000	S2	S1	F3	90.211
S2	S1	F4	90.211	S2	S1	F5	90.211
S2	S1	F6	90.211	S2	S1	F7	180.000
F3	S1	F4	89.999	F3	S1	F5	179.579
F3	S1	F6	89.999	F3	S1	F7	89.789
F4	S1	F5	89.999	F4	S1	F6	179.579
F4	S1	F7	89.789	F5	S1	F6	89.999
F5	S1	F7	89.789	F6	S1	F7	89.789
F8	S2	F9	89.999	F8	S2	F10	179.579
F8	S2	F11	89.999	F8	S2	F12	89.789
F9	S2	F10	89.999	F9	S2	F11	179.579
F9	S2	F12	89.789	F10	S2	F11	89.999
F10	S2	F12	89.789	F11	S2	F12	89.789

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

using model chemistry: wB97X-D/6-31+G**

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	2.322
2	S	2.322
3	F	-0.447
4	F	-0.447
5	F	-0.447
6	F	-0.447
7	F	-0.535
8	F	-0.447
9	F	-0.447
10	F	-0.447
11	F	-0.447
12	F	-0.535

<r²>	508.318
(<r²>)^1/2	22.546

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

using model chemistry: wB97X-D/6-31+G**

States and conformations

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