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	hartrees
Energy at 0K	-1794.159222
Energy at 298.15K
HF Energy	-1794.159222
Nuclear repulsion energy	1412.176911

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	846	839	0.00
2	A₁	620	615	0.00
3	A₁	544	540	0.00
4	A₁	196	194	0.00
5	B₁	77	77	0.00
6	B₂	783	777	598.59
7	B₂	601	596	0.76
8	B₂	487	483	229.97
9	E₁	890	883	581.56
9	E₁	890	883	581.56
10	E₁	486	482	12.42
10	E₁	486	482	12.42
11	E₁	353	350	1.26
11	E₁	353	350	1.26
12	E₁	154	153	0.35
12	E₁	154	153	0.35
13	E₂	589	584	0.00
13	E₂	589	584	0.00
14	E₂	427	424	0.00
14	E₂	427	424	0.00
15	E₂	290	287	0.00
15	E₂	290	287	0.00
16	E₃	830	823	0.00
16	E₃	830	823	0.00
17	E₃	492	488	0.00
17	E₃	492	488	0.00
18	E₃	357	354	0.00
18	E₃	357	354	0.00
19	E₃	205	203	0.00
19	E₃	205	203	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.207
S2	0.000	0.000	-1.207
F3	0.000	1.651	1.205
F4	-1.651	0.000	1.205
F5	0.000	-1.651	1.205
F6	1.651	0.000	1.205
F7	0.000	0.000	2.835
F8	1.168	1.168	-1.205
F9	1.168	-1.168	-1.205
F10	-1.168	-1.168	-1.205
F11	-1.168	1.168	-1.205
F12	0.000	0.000	-2.835

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.4148	1.6512	1.6512	1.6512	1.6512	1.6271	2.9231	2.9231	2.9231	2.9231	4.0419
S2	2.4148		2.9231	2.9231	2.9231	2.9231	4.0419	1.6512	1.6512	1.6512	1.6512	1.6271
F3	1.6512	2.9231		2.3351	3.3023	2.3351	2.3201	2.7207	3.8876	3.8876	2.7207	4.3636
F4	1.6512	2.9231	2.3351		2.3351	3.3023	2.3201	3.8876	3.8876	2.7207	2.7207	4.3636
F5	1.6512	2.9231	3.3023	2.3351		2.3351	2.3201	3.8876	2.7207	2.7207	3.8876	4.3636
F6	1.6512	2.9231	2.3351	3.3023	2.3351		2.3201	2.7207	2.7207	3.8876	3.8876	4.3636
F7	1.6271	4.0419	2.3201	2.3201	2.3201	2.3201		4.3636	4.3636	4.3636	4.3636	5.6690
F8	2.9231	1.6512	2.7207	3.8876	3.8876	2.7207	4.3636		2.3351	3.3023	2.3351	2.3201
F9	2.9231	1.6512	3.8876	3.8876	2.7207	2.7207	4.3636	2.3351		2.3351	3.3023	2.3201
F10	2.9231	1.6512	3.8876	2.7207	2.7207	3.8876	4.3636	3.3023	2.3351		2.3351	2.3201
F11	2.9231	1.6512	2.7207	2.7207	3.8876	3.8876	4.3636	2.3351	3.3023	2.3351		2.3201
F12	4.0419	1.6271	4.3636	4.3636	4.3636	4.3636	5.6690	2.3201	2.3201	2.3201	2.3201

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	89.905	S1	S2	F9	89.905
S1	S2	F10	89.905	S1	S2	F11	89.905
S1	S2	F12	180.000	S2	S1	F3	89.905
S2	S1	F4	89.905	S2	S1	F5	89.905
S2	S1	F6	89.905	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.810
F3	S1	F6	90.000	F3	S1	F7	90.095
F4	S1	F5	90.000	F4	S1	F6	179.810
F4	S1	F7	90.095	F5	S1	F6	90.000
F5	S1	F7	90.095	F6	S1	F7	90.095
F8	S2	F9	90.000	F8	S2	F10	179.810
F8	S2	F11	90.000	F8	S2	F12	90.095
F9	S2	F10	90.000	F9	S2	F11	179.810
F9	S2	F12	90.095	F10	S2	F11	90.000
F10	S2	F12	90.095	F11	S2	F12	90.095

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

using model chemistry: B97D3/cc-pVDZ

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	1.176
2	S	1.176
3	F	-0.239
4	F	-0.239
5	F	-0.239
6	F	-0.239
7	F	-0.220
8	F	-0.239
9	F	-0.239
10	F	-0.239
11	F	-0.239
12	F	-0.220

<r²>	539.342
(<r²>)^1/2	23.224

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

using model chemistry: B97D3/cc-pVDZ

States and conformations

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