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	hartrees
Energy at 0K	-1785.438538
Energy at 298.15K
HF Energy	-1785.438538
Nuclear repulsion energy	1490.579133

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1032	987	0.00
2	A₁	763	730	0.00
3	A₁	648	620	0.00
4	A₁	291	279	0.00
5	B₁	161	154	0.00
6	B₂	947	906	575.94
7	B₂	739	707	0.17
8	B₂	569	544	273.05
9	E₁	1088	1041	577.69
9	E₁	1088	1041	577.69
10	E₁	548	525	35.95
10	E₁	548	525	35.95
11	E₁	420	401	7.19
11	E₁	420	401	7.19
12	E₁	209	200	0.62
12	E₁	209	200	0.62
13	E₂	722	691	0.00
13	E₂	722	691	0.00
14	E₂	485	464	0.00
14	E₂	485	464	0.00
15	E₂	356	340	0.00
15	E₂	356	340	0.00
16	E₃	1013	970	0.00
16	E₃	1013	970	0.00
17	E₃	553	529	0.00
17	E₃	553	529	0.00
18	E₃	407	389	0.00
18	E₃	407	389	0.00
19	E₃	271	259	0.00
19	E₃	271	259	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.097
S2	0.000	0.000	-1.097
F3	0.000	1.583	1.111
F4	-1.583	0.000	1.111
F5	0.000	-1.583	1.111
F6	1.583	0.000	1.111
F7	0.000	0.000	2.670
F8	1.120	1.120	-1.111
F9	1.120	-1.120	-1.111
F10	-1.120	-1.120	-1.111
F11	-1.120	1.120	-1.111
F12	0.000	0.000	-2.670

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.1949	1.5834	1.5834	1.5834	1.5834	1.5723	2.7173	2.7173	2.7173	2.7173	3.7671
S2	2.1949		2.7173	2.7173	2.7173	2.7173	3.7671	1.5834	1.5834	1.5834	1.5834	1.5723
F3	1.5834	2.7173		2.2392	3.1667	2.2392	2.2219	2.5308	3.6737	3.6737	2.5308	4.0988
F4	1.5834	2.7173	2.2392		2.2392	3.1667	2.2219	3.6737	3.6737	2.5308	2.5308	4.0988
F5	1.5834	2.7173	3.1667	2.2392		2.2392	2.2219	3.6737	2.5308	2.5308	3.6737	4.0988
F6	1.5834	2.7173	2.2392	3.1667	2.2392		2.2219	2.5308	2.5308	3.6737	3.6737	4.0988
F7	1.5723	3.7671	2.2219	2.2219	2.2219	2.2219		4.0988	4.0988	4.0988	4.0988	5.3394
F8	2.7173	1.5834	2.5308	3.6737	3.6737	2.5308	4.0988		2.2392	3.1667	2.2392	2.2219
F9	2.7173	1.5834	3.6737	3.6737	2.5308	2.5308	4.0988	2.2392		2.2392	3.1667	2.2219
F10	2.7173	1.5834	3.6737	2.5308	2.5308	3.6737	4.0988	3.1667	2.2392		2.2392	2.2219
F11	2.7173	1.5834	2.5308	2.5308	3.6737	3.6737	4.0988	2.2392	3.1667	2.2392		2.2219
F12	3.7671	1.5723	4.0988	4.0988	4.0988	4.0988	5.3394	2.2219	2.2219	2.2219	2.2219

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.486	S1	S2	F9	90.486
S1	S2	F10	90.486	S1	S2	F11	90.486
S1	S2	F12	180.000	S2	S1	F3	90.486
S2	S1	F4	90.486	S2	S1	F5	90.486
S2	S1	F6	90.486	S2	S1	F7	180.000
F3	S1	F4	89.996	F3	S1	F5	179.028
F3	S1	F6	89.996	F3	S1	F7	89.514
F4	S1	F5	89.996	F4	S1	F6	179.028
F4	S1	F7	89.514	F5	S1	F6	89.996
F5	S1	F7	89.514	F6	S1	F7	89.514
F8	S2	F9	89.996	F8	S2	F10	179.028
F8	S2	F11	89.996	F8	S2	F12	89.514
F9	S2	F10	89.996	F9	S2	F11	179.028
F9	S2	F12	89.514	F10	S2	F11	89.996
F10	S2	F12	89.514	F11	S2	F12	89.514

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

using model chemistry: B1B95/3-21G

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	1.450
2	S	1.450
3	F	-0.293
4	F	-0.293
5	F	-0.293
6	F	-0.293
7	F	-0.277
8	F	-0.293
9	F	-0.293
10	F	-0.293
11	F	-0.293
12	F	-0.277

<r²>	483.170
(<r²>)^1/2	21.981

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

using model chemistry: B1B95/3-21G

States and conformations

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