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	hartrees
Energy at 0K	-1794.614680
Energy at 298.15K
HF Energy	-1794.614680
Nuclear repulsion energy	1458.009785

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	896	857	0.00
2	A₁	656	628	0.00
3	A₁	602	576	0.00
4	A₁	233	223	0.00
5	B₁	96	92	0.00
6	B₂	801	766	646.47
7	B₂	642	614	11.55
8	B₂	514	492	275.30
9	E₁	912	872	670.09
9	E₁	912	872	670.09
10	E₁	532	509	22.48
10	E₁	532	509	22.48
11	E₁	385	369	2.54
11	E₁	385	369	2.54
12	E₁	168	161	0.47
12	E₁	168	161	0.47
13	E₂	603	576	0.00
13	E₂	603	576	0.00
14	E₂	467	447	0.00
14	E₂	467	447	0.00
15	E₂	316	303	0.00
15	E₂	316	303	0.00
16	E₃	835	798	0.00
16	E₃	835	798	0.00
17	E₃	540	517	0.00
17	E₃	540	517	0.00
18	E₃	394	377	0.00
18	E₃	394	377	0.00
19	E₃	235	225	0.00
19	E₃	235	225	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.156
S2	0.000	0.000	-1.156
F3	0.000	1.605	1.157
F4	-1.605	0.000	1.157
F5	0.000	-1.605	1.157
F6	1.605	0.000	1.157
F7	0.000	0.000	2.741
F8	1.135	1.135	-1.157
F9	1.135	-1.135	-1.157
F10	-1.135	-1.135	-1.157
F11	-1.135	1.135	-1.157
F12	0.000	0.000	-2.741

	S1	S2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12
S1		2.3123	1.6050	1.6050	1.6050	1.6050	1.5849	2.8152	2.8152	2.8152	2.8152	3.8972
S2	2.3123		2.8152	2.8152	2.8152	2.8152	3.8972	1.6050	1.6050	1.6050	1.6050	1.5849
F3	1.6050	2.8152		2.2698	3.2099	2.2698	2.2552	2.6195	3.7613	3.7613	2.6195	4.2153
F4	1.6050	2.8152	2.2698		2.2698	3.2099	2.2552	3.7613	3.7613	2.6195	2.6195	4.2153
F5	1.6050	2.8152	3.2099	2.2698		2.2698	2.2552	3.7613	2.6195	2.6195	3.7613	4.2153
F6	1.6050	2.8152	2.2698	3.2099	2.2698		2.2552	2.6195	2.6195	3.7613	3.7613	4.2153
F7	1.5849	3.8972	2.2552	2.2552	2.2552	2.2552		4.2153	4.2153	4.2153	4.2153	5.4821
F8	2.8152	1.6050	2.6195	3.7613	3.7613	2.6195	4.2153		2.2698	3.2099	2.2698	2.2552
F9	2.8152	1.6050	3.7613	3.7613	2.6195	2.6195	4.2153	2.2698		2.2698	3.2099	2.2552
F10	2.8152	1.6050	3.7613	2.6195	2.6195	3.7613	4.2153	3.2099	2.2698		2.2698	2.2552
F11	2.8152	1.6050	2.6195	2.6195	3.7613	3.7613	4.2153	2.2698	3.2099	2.2698		2.2552
F12	3.8972	1.5849	4.2153	4.2153	4.2153	4.2153	5.4821	2.2552	2.2552	2.2552	2.2552

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	F8	90.024	S1	S2	F9	90.024
S1	S2	F10	90.024	S1	S2	F11	90.024
S1	S2	F12	180.000	S2	S1	F3	90.024
S2	S1	F4	90.024	S2	S1	F5	90.024
S2	S1	F6	90.024	S2	S1	F7	180.000
F3	S1	F4	90.000	F3	S1	F5	179.952
F3	S1	F6	90.000	F3	S1	F7	89.976
F4	S1	F5	90.000	F4	S1	F6	179.952
F4	S1	F7	89.976	F5	S1	F6	90.000
F5	S1	F7	89.976	F6	S1	F7	89.976
F8	S2	F9	90.000	F8	S2	F10	179.952
F8	S2	F11	90.000	F8	S2	F12	89.976
F9	S2	F10	90.000	F9	S2	F11	179.952
F9	S2	F12	89.976	F10	S2	F11	90.000
F10	S2	F12	89.976	F11	S2	F12	89.976

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

using model chemistry: mPW1PW91/6-311G**

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	1.346
2	S	1.346
3	F	-0.274
4	F	-0.274
5	F	-0.274
6	F	-0.274
7	F	-0.248
8	F	-0.274
9	F	-0.274
10	F	-0.274
11	F	-0.274
12	F	-0.248

<r²>	508.674
(<r²>)^1/2	22.554

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

using model chemistry: mPW1PW91/6-311G**

States and conformations

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