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	hartrees
Energy at 0K	-1784.706232
Energy at 298.15K
HF Energy	-1784.706232
Nuclear repulsion energy	1380.817278

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	912	912	0.00
2	A₁	622	622	0.00
3	A₁	492	492	0.00
4	A₁	171	171	0.00
5	B₁	53	53	0.00
6	B₂	858	858	421.25
7	B₂	604	604	27.65
8	B₂	407	407	352.61
9	E₁	916	916	382.47
9	E₁	916	916	382.47
10	E₁	408	408	27.37
10	E₁	408	408	27.37
11	E₁	273	273	4.14
11	E₁	273	273	4.14
12	E₁	98	98	0.62
12	E₁	98	98	0.62
13	E₂	614	614	0.00
13	E₂	614	614	0.00
14	E₂	346	346	0.00
14	E₂	346	346	0.00
15	E₂	209	209	0.00
15	E₂	209	209	0.00
16	E₃	866	866	0.00
16	E₃	866	866	0.00
17	E₃	407	407	0.00
17	E₃	407	407	0.00
18	E₃	274	274	0.00
18	E₃	274	274	0.00
19	E₃	134	134	0.00
19	E₃	134	134	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.253
S2	0.000	0.000	-1.253
F3	0.000	1.685	1.238
F4	-1.685	0.000	1.238
F5	0.000	-1.685	1.238
F6	1.685	0.000	1.238
F7	0.000	0.000	2.900
F8	1.191	1.191	-1.238
F9	1.191	-1.191	-1.238
F10	-1.191	-1.191	-1.238
F11	-1.191	1.191	-1.238
F12	0.000	0.000	-2.900

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.5066	1.6846	1.6846	1.6846	1.6846	1.6469	3.0070	3.0070	3.0070	3.0070	4.1534
S2	2.5066		3.0070	3.0070	3.0070	3.0070	4.1534	1.6846	1.6846	1.6846	1.6846	1.6469
F3	1.6846	3.0070		2.3823	3.3692	2.3823	2.3668	2.7909	3.9769	3.9769	2.7909	4.4675
F4	1.6846	3.0070	2.3823		2.3823	3.3692	2.3668	3.9769	3.9769	2.7909	2.7909	4.4675
F5	1.6846	3.0070	3.3692	2.3823		2.3823	2.3668	3.9769	2.7909	2.7909	3.9769	4.4675
F6	1.6846	3.0070	2.3823	3.3692	2.3823		2.3668	2.7909	2.7909	3.9769	3.9769	4.4675
F7	1.6469	4.1534	2.3668	2.3668	2.3668	2.3668		4.4675	4.4675	4.4675	4.4675	5.8003
F8	3.0070	1.6846	2.7909	3.9769	3.9769	2.7909	4.4675		2.3823	3.3691	2.3823	2.3668
F9	3.0070	1.6846	3.9769	3.9769	2.7909	2.7909	4.4675	2.3823		2.3823	3.3691	2.3668
F10	3.0070	1.6846	3.9769	2.7909	2.7909	3.9769	4.4675	3.3691	2.3823		2.3823	2.3668
F11	3.0070	1.6846	2.7909	2.7909	3.9769	3.9769	4.4675	2.3823	3.3691	2.3823		2.3668
F12	4.1534	1.6469	4.4675	4.4675	4.4675	4.4675	5.8003	2.3668	2.3668	2.3668	2.3668

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	89.467	S1	S2	F9	89.467
S1	S2	F10	89.467	S1	S2	F11	89.467
S1	S2	F12	180.000	S2	S1	F3	89.467
S2	S1	F4	89.467	S2	S1	F5	89.467
S2	S1	F6	89.467	S2	S1	F7	180.000
F3	S1	F4	89.995	F3	S1	F5	178.934
F3	S1	F6	89.995	F3	S1	F7	90.533
F4	S1	F5	89.995	F4	S1	F6	178.934
F4	S1	F7	90.533	F5	S1	F6	89.995
F5	S1	F7	90.533	F6	S1	F7	90.533
F8	S2	F9	89.995	F8	S2	F10	178.934
F8	S2	F11	89.995	F8	S2	F12	90.533
F9	S2	F10	89.995	F9	S2	F11	178.934
F9	S2	F12	90.533	F10	S2	F11	89.995
F10	S2	F12	90.533	F11	S2	F12	90.533

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

using model chemistry: wB97X-D/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	1.651
2	S	1.651
3	F	-0.334
4	F	-0.334
5	F	-0.334
6	F	-0.334
7	F	-0.316
8	F	-0.334
9	F	-0.334
10	F	-0.334
11	F	-0.334
12	F	-0.316

<r²>	565.294
(<r²>)^1/2	23.776

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

using model chemistry: wB97X-D/3-21G

States and conformations

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