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	hartrees
Energy at 0K	-1793.507111
Energy at 298.15K
HF Energy	-1793.507111
Nuclear repulsion energy	1451.606214

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	937	902	0.00
2	A₁	690	663	0.00
3	A₁	603	580	0.00
4	A₁	243	234	0.00
5	B₁	97	94	0.00
6	B₂	853	821	614.69
7	B₂	667	642	0.52
8	B₂	531	510	243.04
9	E₁	978	941	631.88
9	E₁	978	941	631.88
10	E₁	525	505	21.92
10	E₁	525	505	21.92
11	E₁	384	370	2.30
11	E₁	384	370	2.30
12	E₁	172	165	0.53
12	E₁	172	165	0.53
13	E₂	648	623	0.00
13	E₂	648	623	0.00
14	E₂	459	442	0.00
14	E₂	459	442	0.00
15	E₂	321	308	0.00
15	E₂	321	308	0.00
16	E₃	910	875	0.00
16	E₃	910	875	0.00
17	E₃	534	514	0.00
17	E₃	534	514	0.00
18	E₃	390	375	0.00
18	E₃	390	375	0.00
19	E₃	238	229	0.00
19	E₃	238	229	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.145
S2	0.000	0.000	-1.145
F3	0.000	1.620	1.148
F4	-1.620	0.000	1.148
F5	0.000	-1.620	1.148
F6	1.620	0.000	1.148
F7	0.000	0.000	2.747
F8	1.145	1.145	-1.148
F9	1.145	-1.145	-1.148
F10	-1.145	-1.145	-1.148
F11	-1.145	1.145	-1.148
F12	0.000	0.000	-2.747

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.2893	1.6196	1.6196	1.6196	1.6196	1.6028	2.8074	2.8074	2.8074	2.8074	3.8920
S2	2.2893		2.8074	2.8074	2.8074	2.8074	3.8920	1.6196	1.6196	1.6196	1.6196	1.6028
F3	1.6196	2.8074		2.2905	3.2393	2.2905	2.2759	2.6101	3.7726	3.7726	2.6101	4.2191
F4	1.6196	2.8074	2.2905		2.2905	3.2393	2.2759	3.7726	3.7726	2.6101	2.6101	4.2191
F5	1.6196	2.8074	3.2393	2.2905		2.2905	2.2759	3.7726	2.6101	2.6101	3.7726	4.2191
F6	1.6196	2.8074	2.2905	3.2393	2.2905		2.2759	2.6101	2.6101	3.7726	3.7726	4.2191
F7	1.6028	3.8920	2.2759	2.2759	2.2759	2.2759		4.2191	4.2191	4.2191	4.2191	5.4948
F8	2.8074	1.6196	2.6101	3.7726	3.7726	2.6101	4.2191		2.2905	3.2393	2.2905	2.2759
F9	2.8074	1.6196	3.7726	3.7726	2.6101	2.6101	4.2191	2.2905		2.2905	3.2393	2.2759
F10	2.8074	1.6196	3.7726	2.6101	2.6101	3.7726	4.2191	3.2393	2.2905		2.2905	2.2759
F11	2.8074	1.6196	2.6101	2.6101	3.7726	3.7726	4.2191	2.2905	3.2393	2.2905		2.2759
F12	3.8920	1.6028	4.2191	4.2191	4.2191	4.2191	5.4948	2.2759	2.2759	2.2759	2.2759

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.136	S1	S2	F9	90.136
S1	S2	F10	90.136	S1	S2	F11	90.136
S1	S2	F12	180.000	S2	S1	F3	90.136
S2	S1	F4	90.136	S2	S1	F5	90.136
S2	S1	F6	90.136	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.727
F3	S1	F6	90.000	F3	S1	F7	89.864
F4	S1	F5	90.000	F4	S1	F6	179.727
F4	S1	F7	89.864	F5	S1	F6	90.000
F5	S1	F7	89.864	F6	S1	F7	89.864
F8	S2	F9	90.000	F8	S2	F10	179.727
F8	S2	F11	90.000	F8	S2	F12	89.864
F9	S2	F10	90.000	F9	S2	F11	179.727
F9	S2	F12	89.864	F10	S2	F11	90.000
F10	S2	F12	89.864	F11	S2	F12	89.864

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

using model chemistry: HSEh1PBE/cc-pVDZ

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	1.215
2	S	1.215
3	F	-0.247
4	F	-0.247
5	F	-0.247
6	F	-0.247
7	F	-0.228
8	F	-0.247
9	F	-0.247
10	F	-0.247
11	F	-0.247
12	F	-0.228

<r²>	509.279
(<r²>)^1/2	22.567

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

using model chemistry: HSEh1PBE/cc-pVDZ

States and conformations

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