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	hartrees
Energy at 0K	-1784.261414
Energy at 298.15K
HF Energy	-1784.261414
Nuclear repulsion energy	1461.608588

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	937	894	0.00
2	A₁	683	651	0.00
3	A₁	575	548	0.00
4	A₁	239	228	0.00
5	B₁	106	101	0.00
6	B₂	870	829	515.23
7	B₂	658	628	2.59
8	B₂	519	495	225.03
9	E₁	988	942	498.51
9	E₁	988	942	498.51
10	E₁	498	475	22.59
10	E₁	498	475	22.59
11	E₁	363	346	4.49
11	E₁	363	346	4.49
12	E₁	169	162	0.73
12	E₁	169	162	0.73
13	E₂	654	624	0.00
13	E₂	654	624	0.00
14	E₂	435	414	0.00
14	E₂	435	414	0.00
15	E₂	303	289	0.00
15	E₂	303	289	0.00
16	E₃	918	875	0.00
16	E₃	918	875	0.00
17	E₃	500	476	0.00
17	E₃	500	476	0.00
18	E₃	367	350	0.00
18	E₃	367	350	0.00
19	E₃	220	210	0.00
19	E₃	220	210	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.123
S2	0.000	0.000	-1.123
F3	0.000	1.616	1.125
F4	-1.616	0.000	1.125
F5	0.000	-1.616	1.125
F6	1.616	0.000	1.125
F7	0.000	0.000	2.723
F8	1.143	1.143	-1.125
F9	1.143	-1.143	-1.125
F10	-1.143	-1.143	-1.125
F11	-1.143	1.143	-1.125
F12	0.000	0.000	-2.723

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.2464	1.6164	1.6164	1.6164	1.6164	1.6002	2.7691	2.7691	2.7691	2.7691	3.8466
S2	2.2464		2.7691	2.7691	2.7691	2.7691	3.8466	1.6164	1.6164	1.6164	1.6164	1.6002
F3	1.6164	2.7691		2.2859	3.2328	2.2859	2.2731	2.5679	3.7395	3.7395	2.5679	4.1742
F4	1.6164	2.7691	2.2859		2.2859	3.2328	2.2731	3.7395	3.7395	2.5679	2.5679	4.1742
F5	1.6164	2.7691	3.2328	2.2859		2.2859	2.2731	3.7395	2.5679	2.5679	3.7395	4.1742
F6	1.6164	2.7691	2.2859	3.2328	2.2859		2.2731	2.5679	2.5679	3.7395	3.7395	4.1742
F7	1.6002	3.8466	2.2731	2.2731	2.2731	2.2731		4.1742	4.1742	4.1742	4.1742	5.4467
F8	2.7691	1.6164	2.5679	3.7395	3.7395	2.5679	4.1742		2.2859	3.2328	2.2859	2.2731
F9	2.7691	1.6164	3.7395	3.7395	2.5679	2.5679	4.1742	2.2859		2.2859	3.2328	2.2731
F10	2.7691	1.6164	3.7395	2.5679	2.5679	3.7395	4.1742	3.2328	2.2859		2.2859	2.2731
F11	2.7691	1.6164	2.5679	2.5679	3.7395	3.7395	4.1742	2.2859	3.2328	2.2859		2.2731
F12	3.8466	1.6002	4.1742	4.1742	4.1742	4.1742	5.4467	2.2731	2.2731	2.2731	2.2731

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.068	S1	S2	F9	90.068
S1	S2	F10	90.068	S1	S2	F11	90.068
S1	S2	F12	180.000	S2	S1	F3	90.068
S2	S1	F4	90.068	S2	S1	F5	90.068
S2	S1	F6	90.068	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.864
F3	S1	F6	90.000	F3	S1	F7	89.932
F4	S1	F5	90.000	F4	S1	F6	179.864
F4	S1	F7	89.932	F5	S1	F6	90.000
F5	S1	F7	89.932	F6	S1	F7	89.932
F8	S2	F9	90.000	F8	S2	F10	179.864
F8	S2	F11	90.000	F8	S2	F12	89.932
F9	S2	F10	90.000	F9	S2	F11	179.864
F9	S2	F12	89.932	F10	S2	F11	90.000
F10	S2	F12	89.932	F11	S2	F12	89.932

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

using model chemistry: PBEPBE/3-21G*

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	1.292
2	S	1.292
3	F	-0.262
4	F	-0.262
5	F	-0.262
6	F	-0.262
7	F	-0.244
8	F	-0.262
9	F	-0.262
10	F	-0.262
11	F	-0.262
12	F	-0.244

<r²>	499.776
(<r²>)^1/2	22.356

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

using model chemistry: PBEPBE/3-21G*

States and conformations

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