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	hartrees
Energy at 0K	-1794.645432
Energy at 298.15K
HF Energy	-1794.645432
Nuclear repulsion energy	1426.154144

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	823	810	0.00
2	A₁	605	596	0.00
3	A₁	564	555	0.00
4	A₁	185	182	0.00
5	B₁	73	72	0.00
6	B₂	749	738	627.52
7	B₂	600	591	8.91
8	B₂	475	468	241.60
9	E₁	842	829	607.57
9	E₁	842	829	607.57
10	E₁	510	503	6.34
10	E₁	510	503	6.34
11	E₁	364	358	0.47
11	E₁	364	358	0.47
12	E₁	153	151	0.11
12	E₁	153	151	0.11
13	E₂	557	549	0.00
13	E₂	557	549	0.00
14	E₂	449	442	0.00
14	E₂	449	442	0.00
15	E₂	294	290	0.00
15	E₂	294	290	0.00
16	E₃	775	763	0.00
16	E₃	775	763	0.00
17	E₃	517	509	0.00
17	E₃	517	509	0.00
18	E₃	373	368	0.00
18	E₃	373	368	0.00
19	E₃	209	206	0.00
19	E₃	209	206	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.217
S2	0.000	0.000	-1.217
F3	0.000	1.624	1.216
F4	-1.624	0.000	1.216
F5	0.000	-1.624	1.216
F6	1.624	0.000	1.216
F7	0.000	0.000	2.814
F8	1.148	1.148	-1.216
F9	1.148	-1.148	-1.216
F10	-1.148	-1.148	-1.216
F11	-1.148	1.148	-1.216
F12	0.000	0.000	-2.814

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.4333	1.6241	1.6241	1.6241	1.6241	1.5969	2.9251	2.9251	2.9251	2.9251	4.0302
S2	2.4333		2.9251	2.9251	2.9251	2.9251	4.0302	1.6241	1.6241	1.6241	1.6241	1.5969
F3	1.6241	2.9251		2.2968	3.2481	2.2968	2.2780	2.7315	3.8628	3.8628	2.7315	4.3447
F4	1.6241	2.9251	2.2968		2.2968	3.2481	2.2780	3.8628	3.8628	2.7315	2.7315	4.3447
F5	1.6241	2.9251	3.2481	2.2968		2.2968	2.2780	3.8628	2.7315	2.7315	3.8628	4.3447
F6	1.6241	2.9251	2.2968	3.2481	2.2968		2.2780	2.7315	2.7315	3.8628	3.8628	4.3447
F7	1.5969	4.0302	2.2780	2.2780	2.2780	2.2780		4.3447	4.3447	4.3447	4.3447	5.6271
F8	2.9251	1.6241	2.7315	3.8628	3.8628	2.7315	4.3447		2.2968	3.2481	2.2968	2.2780
F9	2.9251	1.6241	3.8628	3.8628	2.7315	2.7315	4.3447	2.2968		2.2968	3.2481	2.2780
F10	2.9251	1.6241	3.8628	2.7315	2.7315	3.8628	4.3447	3.2481	2.2968		2.2968	2.2780
F11	2.9251	1.6241	2.7315	2.7315	3.8628	3.8628	4.3447	2.2968	3.2481	2.2968		2.2780
F12	4.0302	1.5969	4.3447	4.3447	4.3447	4.3447	5.6271	2.2780	2.2780	2.2780	2.2780

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	179.964
F3	S1	F6	90.000	F3	S1	F7	90.018
F4	S1	F5	90.000	F4	S1	F6	179.964
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	179.964
F8	S2	F11	90.000	F8	S2	F12	90.018
F9	S2	F10	90.000	F9	S2	F11	179.964
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/aug-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	2.624
2	S	2.624
3	F	-0.527
4	F	-0.527
5	F	-0.527
6	F	-0.527
7	F	-0.517
8	F	-0.527
9	F	-0.527
10	F	-0.527
11	F	-0.527
12	F	-0.517

<r²>	533.934
(<r²>)^1/2	23.107

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

using model chemistry: B97D3/aug-cc-pVTZ

States and conformations

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