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	hartrees
Energy at 0K	-894.056997
Energy at 298.15K	-894.060200
HF Energy	-894.056997
Nuclear repulsion energy	417.241322

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	892	878	114.51
2	A₁	631	620	4.99
3	A₁	519	511	19.12
4	B₁	435	428	0.00
5	B₂	589	580	0.00
6	B₂	226	223	0.00
7	E	851	837	350.37
7	E	851	837	350.37
8	E	494	486	1.78
8	E	494	486	1.78
9	E	337	331	0.04
9	E	337	331	0.04

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.205
F2	0.000	0.000	-1.343
F3	0.000	1.605	0.244
F4	-1.605	0.000	0.244
F5	0.000	-1.605	0.244
F6	1.605	0.000	0.244

	S1	F2	F3	F4	F5	F6
S1		1.5482	1.6056	1.6056	1.6056	1.6056
F2	1.5482		2.2575	2.2575	2.2575	2.2575
F3	1.6056	2.2575		2.2700	3.2103	2.2700
F4	1.6056	2.2575	2.2700		2.2700	3.2103
F5	1.6056	2.2575	3.2103	2.2700		2.2700
F6	1.6056	2.2575	2.2700	3.2103	2.2700

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	91.399	F2	S1	F4	91.399
F2	S1	F5	91.399	F2	S1	F6	91.399
F3	S1	F4	89.966	F3	S1	F5	177.202
F3	S1	F6	89.966	F4	S1	F5	89.966
F4	S1	F6	177.202	F5	S1	F6	89.966

All results from a given calculation for SF₅ (Sulfur pentafluoride)

using model chemistry: LSDA/6-31G(2df,p)

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	0.385
2	F	0.036
3	F	-0.105
4	F	-0.105
5	F	-0.105
6	F	-0.105

	x	y	z	Total
	0.000	0.000	0.183	0.183
CHELPG
AIM
ESP

<r²>	134.611
(<r²>)^1/2	11.602

All results from a given calculation for SF5 (Sulfur pentafluoride)

using model chemistry: LSDA/6-31G(2df,p)

States and conformations

All results from a given calculation for SF₅ (Sulfur pentafluoride)