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	hartrees
Energy at 0K	-1794.318833
Energy at 298.15K
HF Energy	-1794.318833
Nuclear repulsion energy	1287.716092

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	710	682	0.00
2	A₁	498	478	0.00
3	A₁	357	343	0.00
4	A₁	107	103	0.00
5	B₁	26	25	0.00
6	B₂	690	664	356.63
7	B₂	488	469	30.81
8	B₂	330	317	261.37
9	E₁	695	669	379.27
9	E₁	695	669	379.27
10	E₁	343	330	12.60
10	E₁	343	330	12.60
11	E₁	235	226	1.74
11	E₁	235	226	1.74
12	E₁	74	71	0.32
12	E₁	74	71	0.32
13	E₂	485	466	0.00
13	E₂	485	466	0.00
14	E₂	302	290	0.00
14	E₂	302	290	0.00
15	E₂	164	158	0.00
15	E₂	164	158	0.00
16	E₃	653	628	0.00
16	E₃	653	628	0.00
17	E₃	344	331	0.00
17	E₃	344	331	0.00
18	E₃	237	227	0.00
18	E₃	237	227	0.00
19	E₃	101	97	0.00
19	E₃	101	97	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.409
S2	0.000	0.000	-1.409
F3	0.000	1.783	1.374
F4	-1.783	0.000	1.374
F5	0.000	-1.783	1.374
F6	1.783	0.000	1.374
F7	0.000	0.000	3.122
F8	1.261	1.261	-1.374
F9	1.261	-1.261	-1.374
F10	-1.261	-1.261	-1.374
F11	-1.261	1.261	-1.374
F12	0.000	0.000	-3.122

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.8188	1.7837	1.7837	1.7837	1.7837	1.7123	3.3054	3.3054	3.3054	3.3054	4.5311
S2	2.8188		3.3054	3.3054	3.3054	3.3054	4.5311	1.7837	1.7837	1.7837	1.7837	1.7123
F3	1.7837	3.3054		2.5220	3.5667	2.5220	2.4972	3.0677	4.2902	4.2902	3.0677	4.8362
F4	1.7837	3.3054	2.5220		2.5220	3.5667	2.4972	4.2902	4.2902	3.0677	3.0677	4.8362
F5	1.7837	3.3054	3.5667	2.5220		2.5220	2.4972	4.2902	3.0677	3.0677	4.2902	4.8362
F6	1.7837	3.3054	2.5220	3.5667	2.5220		2.4972	3.0677	3.0677	4.2902	4.2902	4.8362
F7	1.7123	4.5311	2.4972	2.4972	2.4972	2.4972		4.8362	4.8362	4.8362	4.8362	6.2435
F8	3.3054	1.7837	3.0677	4.2902	4.2902	3.0677	4.8362		2.5221	3.5667	2.5221	2.4972
F9	3.3054	1.7837	4.2902	4.2902	3.0677	3.0677	4.8362	2.5221		2.5221	3.5667	2.4972
F10	3.3054	1.7837	4.2902	3.0677	3.0677	4.2902	4.8362	3.5667	2.5221		2.5221	2.4972
F11	3.3054	1.7837	3.0677	3.0677	4.2902	4.2902	4.8362	2.5221	3.5667	2.5221		2.4972
F12	4.5311	1.7123	4.8362	4.8362	4.8362	4.8362	6.2435	2.4972	2.4972	2.4972	2.4972

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	88.851	S1	S2	F9	88.851
S1	S2	F10	88.851	S1	S2	F11	88.851
S1	S2	F12	180.000	S2	S1	F3	88.851
S2	S1	F4	88.851	S2	S1	F5	88.851
S2	S1	F6	88.851	S2	S1	F7	180.000
F3	S1	F4	89.977	F3	S1	F5	177.702
F3	S1	F6	89.977	F3	S1	F7	91.149
F4	S1	F5	89.977	F4	S1	F6	177.702
F4	S1	F7	91.149	F5	S1	F6	89.977
F5	S1	F7	91.149	F6	S1	F7	91.149
F8	S2	F9	89.977	F8	S2	F10	177.702
F8	S2	F11	89.977	F8	S2	F12	91.149
F9	S2	F10	89.977	F9	S2	F11	177.702
F9	S2	F12	91.149	F10	S2	F11	89.977
F10	S2	F12	91.149	F11	S2	F12	91.149

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

using model chemistry: B3LYP/SDD

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	1.516
2	S	1.516
3	F	-0.309
4	F	-0.309
5	F	-0.309
6	F	-0.309
7	F	-0.282
8	F	-0.309
9	F	-0.309
10	F	-0.309
11	F	-0.309
12	F	-0.282

<r²>	655.977
(<r²>)^1/2	25.612

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

using model chemistry: B3LYP/SDD

States and conformations

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