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	hartrees
Energy at 0K	-1769.627087
Energy at 298.15K
HF Energy	-1769.627087
Nuclear repulsion energy	1281.872658

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	769	703	0.00
2	A₁	566	517	0.00
3	A₁	387	354	0.00
4	A₁	105	96	0.00
5	B₁	22	20	0.00
6	B₂	721	659	251.04
7	B₂	566	517	1.87
8	B₂	343	313	113.19
9	E₁	842	770	187.44
9	E₁	842	770	187.44
10	E₁	339	310	9.02
10	E₁	339	310	9.02
11	E₁	224	205	0.63
11	E₁	224	205	0.63
12	E₁	57	52	0.37
12	E₁	57	52	0.37
13	E₂	534	488	0.00
13	E₂	534	488	0.00
14	E₂	286	261	0.00
14	E₂	286	261	0.00
15	E₂	190	174	0.00
15	E₂	190	174	0.00
16	E₃	837	764	0.00
16	E₃	837	764	0.00
17	E₃	341	311	0.00
17	E₃	341	311	0.00
18	E₃	234	214	0.00
18	E₃	234	214	0.00
19	E₃	105	96	0.00
19	E₃	105	96	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.371
S2	0.000	0.000	-1.371
F3	0.000	1.779	1.435
F4	-1.779	0.000	1.435
F5	0.000	-1.779	1.435
F6	1.779	0.000	1.435
F7	0.000	0.000	3.141
F8	1.258	1.258	-1.435
F9	1.258	-1.258	-1.435
F10	-1.258	-1.258	-1.435
F11	-1.258	1.258	-1.435
F12	0.000	0.000	-3.141

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.7429	1.7805	1.7805	1.7805	1.7805	1.7694	3.3229	3.3229	3.3229	3.3229	4.5124
S2	2.7429		3.3229	3.3229	3.3229	3.3229	4.5124	1.7805	1.7805	1.7805	1.7805	1.7694
F3	1.7805	3.3229		2.5164	3.5588	2.5164	2.4651	3.1765	4.3641	4.3641	3.1765	4.9096
F4	1.7805	3.3229	2.5164		2.5164	3.5588	2.4651	4.3641	4.3641	3.1765	3.1765	4.9096
F5	1.7805	3.3229	3.5588	2.5164		2.5164	2.4651	4.3641	3.1765	3.1765	4.3641	4.9096
F6	1.7805	3.3229	2.5164	3.5588	2.5164		2.4651	3.1765	3.1765	4.3641	4.3641	4.9096
F7	1.7694	4.5124	2.4651	2.4651	2.4651	2.4651		4.9096	4.9096	4.9096	4.9096	6.2818
F8	3.3229	1.7805	3.1765	4.3641	4.3641	3.1765	4.9096		2.5164	3.5588	2.5164	2.4651
F9	3.3229	1.7805	4.3641	4.3641	3.1765	3.1765	4.9096	2.5164		2.5164	3.5588	2.4651
F10	3.3229	1.7805	4.3641	3.1765	3.1765	4.3641	4.9096	3.5588	2.5164		2.5164	2.4651
F11	3.3229	1.7805	3.1765	3.1765	4.3641	4.3641	4.9096	2.5164	3.5588	2.5164		2.4651
F12	4.5124	1.7694	4.9096	4.9096	4.9096	4.9096	6.2818	2.4651	2.4651	2.4651	2.4651

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	92.041	S1	S2	F9	92.041
S1	S2	F10	92.041	S1	S2	F11	92.041
S1	S2	F12	180.000	S2	S1	F3	92.041
S2	S1	F4	92.041	S2	S1	F5	92.041
S2	S1	F6	92.041	S2	S1	F7	180.000
F3	S1	F4	89.927	F3	S1	F5	175.917
F3	S1	F6	89.927	F3	S1	F7	87.959
F4	S1	F5	89.927	F4	S1	F6	175.917
F4	S1	F7	87.959	F5	S1	F6	89.927
F5	S1	F7	87.959	F6	S1	F7	87.959
F8	S2	F9	89.927	F8	S2	F10	175.917
F8	S2	F11	89.927	F8	S2	F12	87.959
F9	S2	F10	89.927	F9	S2	F11	175.917
F9	S2	F12	87.959	F10	S2	F11	89.927
F10	S2	F12	87.959	F11	S2	F12	87.959

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

using model chemistry: PBEPBE/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	0.697
2	S	0.697
3	F	-0.140
4	F	-0.140
5	F	-0.140
6	F	-0.140
7	F	-0.136
8	F	-0.140
9	F	-0.140
10	F	-0.140
11	F	-0.140
12	F	-0.136

<r²>	655.613
(<r²>)^1/2	25.605

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

using model chemistry: PBEPBE/STO-3G

States and conformations

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