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	hartrees
Energy at 0K	-1770.764093
Energy at 298.15K
HF Energy	-1770.764093
Nuclear repulsion energy	1312.399634

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	826	737	0.00
2	A₁	596	532	0.00
3	A₁	430	384	0.00
4	A₁	132	118	0.00
5	B₁	15	14	0.00
6	B₂	759	677	280.95
7	B₂	592	528	1.30
8	B₂	369	329	170.00
9	E₁	896	799	220.31
9	E₁	896	799	220.31
10	E₁	358	319	14.93
10	E₁	358	319	14.93
11	E₁	238	212	1.35
11	E₁	238	212	1.35
12	E₁	68	61	0.55
12	E₁	68	61	0.55
13	E₂	574	512	0.00
13	E₂	574	512	0.00
14	E₂	301	268	0.00
14	E₂	301	268	0.00
15	E₂	201	179	0.00
15	E₂	201	179	0.00
16	E₃	887	792	0.00
16	E₃	887	792	0.00
17	E₃	361	322	0.00
17	E₃	361	322	0.00
18	E₃	250	223	0.00
18	E₃	250	223	0.00
19	E₃	122	109	0.00
19	E₃	122	109	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.308
S2	0.000	0.000	-1.308
F3	0.000	1.754	1.370
F4	-1.754	0.000	1.370
F5	0.000	-1.754	1.370
F6	1.754	0.000	1.370
F7	0.000	0.000	3.052
F8	1.240	1.240	-1.370
F9	1.240	-1.240	-1.370
F10	-1.240	-1.240	-1.370
F11	-1.240	1.240	-1.370
F12	0.000	0.000	-3.052

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.6163	1.7550	1.7550	1.7550	1.7550	1.7443	3.2011	3.2011	3.2011	3.2011	4.3606
S2	2.6163		3.2011	3.2011	3.2011	3.2011	4.3606	1.7550	1.7550	1.7550	1.7550	1.7443
F3	1.7550	3.2011		2.4805	3.5079	2.4805	2.4307	3.0506	4.2435	4.2435	3.0506	4.7573
F4	1.7550	3.2011	2.4805		2.4805	3.5079	2.4307	4.2435	4.2435	3.0506	3.0506	4.7573
F5	1.7550	3.2011	3.5079	2.4805		2.4805	2.4307	4.2435	3.0506	3.0506	4.2435	4.7573
F6	1.7550	3.2011	2.4805	3.5079	2.4805		2.4307	3.0506	3.0506	4.2435	4.2435	4.7573
F7	1.7443	4.3606	2.4307	2.4307	2.4307	2.4307		4.7573	4.7573	4.7573	4.7573	6.1050
F8	3.2011	1.7550	3.0506	4.2435	4.2435	3.0506	4.7573		2.4805	3.5079	2.4805	2.4307
F9	3.2011	1.7550	4.2435	4.2435	3.0506	3.0506	4.7573	2.4805		2.4805	3.5079	2.4307
F10	3.2011	1.7550	4.2435	3.0506	3.0506	4.2435	4.7573	3.5079	2.4805		2.4805	2.4307
F11	3.2011	1.7550	3.0506	3.0506	4.2435	4.2435	4.7573	2.4805	3.5079	2.4805		2.4307
F12	4.3606	1.7443	4.7573	4.7573	4.7573	4.7573	6.1050	2.4307	2.4307	2.4307	2.4307

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	92.010	S1	S2	F9	92.010
S1	S2	F10	92.010	S1	S2	F11	92.010
S1	S2	F12	180.000	S2	S1	F3	92.010
S2	S1	F4	92.010	S2	S1	F5	92.010
S2	S1	F6	92.010	S2	S1	F7	180.000
F3	S1	F4	89.930	F3	S1	F5	175.980
F3	S1	F6	89.930	F3	S1	F7	87.990
F4	S1	F5	89.930	F4	S1	F6	175.980
F4	S1	F7	87.990	F5	S1	F6	89.930
F5	S1	F7	87.990	F6	S1	F7	87.990
F8	S2	F9	89.930	F8	S2	F10	175.980
F8	S2	F11	89.930	F8	S2	F12	87.990
F9	S2	F10	89.930	F9	S2	F11	175.980
F9	S2	F12	87.990	F10	S2	F11	89.930
F10	S2	F12	87.990	F11	S2	F12	87.990

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

using model chemistry: B3LYP/STO-3G

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	0.816
2	S	0.816
3	F	-0.166
4	F	-0.166
5	F	-0.166
6	F	-0.166
7	F	-0.152
8	F	-0.166
9	F	-0.166
10	F	-0.166
11	F	-0.166
12	F	-0.152

<r²>	621.350
(<r²>)^1/2	24.927

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

using model chemistry: B3LYP/STO-3G

States and conformations

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