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	hartrees
Energy at 0K	-1794.622477
Energy at 298.15K
HF Energy	-1794.622477
Nuclear repulsion energy	1428.542846

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	835	823	0.00
2	A₁	613	604	0.00
3	A₁	569	561	0.00
4	A₁	189	187	0.00
5	B₁	77	76	0.00
6	B₂	761	750	644.16
7	B₂	606	598	7.89
8	B₂	484	478	238.44
9	E₁	856	844	627.52
9	E₁	856	844	627.52
10	E₁	514	507	6.95
10	E₁	514	507	6.95
11	E₁	368	363	0.69
11	E₁	368	363	0.69
12	E₁	157	155	0.15
12	E₁	157	155	0.15
13	E₂	565	557	0.00
13	E₂	565	557	0.00
14	E₂	453	447	0.00
14	E₂	453	447	0.00
15	E₂	299	295	0.00
15	E₂	299	295	0.00
16	E₃	787	776	0.00
16	E₃	787	776	0.00
17	E₃	521	514	0.00
17	E₃	521	514	0.00
18	E₃	377	372	0.00
18	E₃	377	372	0.00
19	E₃	213	210	0.00
19	E₃	213	210	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.212
S2	0.000	0.000	-1.212
F3	0.000	1.623	1.212
F4	-1.623	0.000	1.212
F5	0.000	-1.623	1.212
F6	1.623	0.000	1.212
F7	0.000	0.000	2.808
F8	1.147	1.147	-1.212
F9	1.147	-1.147	-1.212
F10	-1.147	-1.147	-1.212
F11	-1.147	1.147	-1.212
F12	0.000	0.000	-2.808

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.4246	1.6226	1.6226	1.6226	1.6226	1.5955	2.9170	2.9170	2.9170	2.9170	4.0201
S2	2.4246		2.9170	2.9170	2.9170	2.9170	4.0201	1.6226	1.6226	1.6226	1.6226	1.5955
F3	1.6226	2.9170		2.2946	3.2451	2.2946	2.2760	2.7232	3.8552	3.8552	2.7232	4.3347
F4	1.6226	2.9170	2.2946		2.2946	3.2451	2.2760	3.8552	3.8552	2.7232	2.7232	4.3347
F5	1.6226	2.9170	3.2451	2.2946		2.2946	2.2760	3.8552	2.7232	2.7232	3.8552	4.3347
F6	1.6226	2.9170	2.2946	3.2451	2.2946		2.2760	2.7232	2.7232	3.8552	3.8552	4.3347
F7	1.5955	4.0201	2.2760	2.2760	2.2760	2.2760		4.3347	4.3347	4.3347	4.3347	5.6157
F8	2.9170	1.6226	2.7232	3.8552	3.8552	2.7232	4.3347		2.2946	3.2451	2.2946	2.2760
F9	2.9170	1.6226	3.8552	3.8552	2.7232	2.7232	4.3347	2.2946		2.2946	3.2451	2.2760
F10	2.9170	1.6226	3.8552	2.7232	2.7232	3.8552	4.3347	3.2451	2.2946		2.2946	2.2760
F11	2.9170	1.6226	2.7232	2.7232	3.8552	3.8552	4.3347	2.2946	3.2451	2.2946		2.2760
F12	4.0201	1.5955	4.3347	4.3347	4.3347	4.3347	5.6157	2.2760	2.2760	2.2760	2.2760

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	89.982	S1	S2	F9	89.982
S1	S2	F10	89.982	S1	S2	F11	89.982
S1	S2	F12	180.000	S2	S1	F3	89.982
S2	S1	F4	89.982	S2	S1	F5	89.982
S2	S1	F6	89.982	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.965
F3	S1	F6	90.000	F3	S1	F7	90.018
F4	S1	F5	90.000	F4	S1	F6	179.965
F4	S1	F7	90.018	F5	S1	F6	90.000
F5	S1	F7	90.018	F6	S1	F7	90.018
F8	S2	F9	90.000	F8	S2	F10	179.965
F8	S2	F11	90.000	F8	S2	F12	90.018
F9	S2	F10	90.000	F9	S2	F11	179.965
F9	S2	F12	90.018	F10	S2	F11	90.000
F10	S2	F12	90.018	F11	S2	F12	90.018

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

using model chemistry: B97D3/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	0.968
2	S	0.968
3	F	-0.201
4	F	-0.201
5	F	-0.201
6	F	-0.201
7	F	-0.165
8	F	-0.201
9	F	-0.201
10	F	-0.201
11	F	-0.201
12	F	-0.165

<r²>	531.366
(<r²>)^1/2	23.051

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

using model chemistry: B97D3/cc-pVTZ

States and conformations

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