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	hartrees
Energy at 0K	-1795.091585
Energy at 298.15K
HF Energy	-1795.091585
Nuclear repulsion energy	1448.839673

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	876	848	0.00
2	A₁	648	627	0.00
3	A₁	597	577	0.00
4	A₁	209	203	0.00
5	B₁	78	75	0.00
6	B₂	791	765	628.01
7	B₂	639	618	15.91
8	B₂	503	486	249.49
9	E₁	891	862	631.23
9	E₁	891	862	631.23
10	E₁	534	517	12.38
10	E₁	534	517	12.38
11	E₁	381	369	0.98
11	E₁	381	369	0.98
12	E₁	160	155	0.20
12	E₁	160	155	0.20
13	E₂	593	573	0.00
13	E₂	593	573	0.00
14	E₂	467	452	0.00
14	E₂	467	452	0.00
15	E₂	311	301	0.00
15	E₂	311	301	0.00
16	E₃	820	793	0.00
16	E₃	820	793	0.00
17	E₃	542	524	0.00
17	E₃	542	524	0.00
18	E₃	394	381	0.00
18	E₃	394	381	0.00
19	E₃	226	219	0.00
19	E₃	226	219	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.179
S2	0.000	0.000	-1.179
F3	0.000	1.607	1.182
F4	-1.607	0.000	1.182
F5	0.000	-1.607	1.182
F6	1.607	0.000	1.182
F7	0.000	0.000	2.763
F8	1.136	1.136	-1.182
F9	1.136	-1.136	-1.182
F10	-1.136	-1.136	-1.182
F11	-1.136	1.136	-1.182
F12	0.000	0.000	-2.763

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3570	1.6068	1.6068	1.6068	1.6068	1.5845	2.8558	2.8558	2.8558	2.8558	3.9415
S2	2.3570		2.8558	2.8558	2.8558	2.8558	3.9415	1.6068	1.6068	1.6068	1.6068	1.5845
F3	1.6068	2.8558		2.2723	3.2135	2.2723	2.2539	2.6654	3.7956	3.7956	2.6654	4.2600
F4	1.6068	2.8558	2.2723		2.2723	3.2135	2.2539	3.7956	3.7956	2.6654	2.6654	4.2600
F5	1.6068	2.8558	3.2135	2.2723		2.2723	2.2539	3.7956	2.6654	2.6654	3.7956	4.2600
F6	1.6068	2.8558	2.2723	3.2135	2.2723		2.2539	2.6654	2.6654	3.7956	3.7956	4.2600
F7	1.5845	3.9415	2.2539	2.2539	2.2539	2.2539		4.2600	4.2600	4.2600	4.2600	5.5260
F8	2.8558	1.6068	2.6654	3.7956	3.7956	2.6654	4.2600		2.2723	3.2135	2.2723	2.2539
F9	2.8558	1.6068	3.7956	3.7956	2.6654	2.6654	4.2600	2.2723		2.2723	3.2135	2.2539
F10	2.8558	1.6068	3.7956	2.6654	2.6654	3.7956	4.2600	3.2135	2.2723		2.2723	2.2539
F11	2.8558	1.6068	2.6654	2.6654	3.7956	3.7956	4.2600	2.2723	3.2135	2.2723		2.2539
F12	3.9415	1.5845	4.2600	4.2600	4.2600	4.2600	5.5260	2.2539	2.2539	2.2539	2.2539

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.138	S1	S2	F9	90.138
S1	S2	F10	90.138	S1	S2	F11	90.138
S1	S2	F12	180.000	S2	S1	F3	90.138
S2	S1	F4	90.138	S2	S1	F5	90.138
S2	S1	F6	90.138	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.725
F3	S1	F6	90.000	F3	S1	F7	89.862
F4	S1	F5	90.000	F4	S1	F6	179.725
F4	S1	F7	89.862	F5	S1	F6	90.000
F5	S1	F7	89.862	F6	S1	F7	89.862
F8	S2	F9	90.000	F8	S2	F10	179.725
F8	S2	F11	90.000	F8	S2	F12	89.862
F9	S2	F10	90.000	F9	S2	F11	179.725
F9	S2	F12	89.862	F10	S2	F11	90.000
F10	S2	F12	89.862	F11	S2	F12	89.862

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

using model chemistry: B3LYP/aug-cc-pVTZ

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	2.695
2	S	2.695
3	F	-0.542
4	F	-0.542
5	F	-0.542
6	F	-0.542
7	F	-0.526
8	F	-0.542
9	F	-0.542
10	F	-0.542
11	F	-0.542
12	F	-0.526

<r²>	516.561
(<r²>)^1/2	22.728

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

using model chemistry: B3LYP/aug-cc-pVTZ

States and conformations

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