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	hartrees
Energy at 0K	-860.586321
Energy at 298.15K	-860.587839
HF Energy	-860.586321
Nuclear repulsion energy	365.256184

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1033	944	47.75
2	A₁	611	558	12.12
3	A₁	548	500	0.61
4	A₁	334	305	9.75
5	A₁	116	106	0.40
6	A₂	296	270	0.00
7	B₁	703	642	70.88
8	B₁	294	269	7.42
9	B₁	59	54	1.77
10	B₂	845	772	132.98
11	B₂	373	341	11.88
12	B₂	331	303	1.30

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.184
O2	0.000	0.000	1.805
F3	0.000	1.769	-0.013
F4	0.000	-1.769	-0.013
F5	1.384	0.000	-0.953
F6	-1.384	0.000	-0.953

	S1	O2	F3	F4	F5	F6
S1		1.6213	1.7800	1.7800	1.7907	1.7907
O2	1.6213		2.5365	2.5365	3.0854	3.0854
F3	1.7800	2.5365		3.5384	2.4349	2.4349
F4	1.7800	2.5365	3.5384		2.4349	2.4349
F5	1.7907	3.0854	2.4349	2.4349		2.7679
F6	1.7907	3.0854	2.4349	2.4349	2.7679

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	96.332	O2	S1	F4	96.332
O2	S1	F5	129.387	O2	S1	F6	129.387
F3	S1	F4	167.337	F3	S1	F5	85.987
F3	S1	F6	85.987	F4	S1	F5	85.987
F4	S1	F6	85.987	F5	S1	F6	101.226

All results from a given calculation for SOF₄ (Sulfur tetrafluoride oxide)

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	0.804
2	O	-0.271
3	F	-0.143
4	F	-0.143
5	F	-0.124
6	F	-0.124

	x	y	z	Total
	0.000	0.000	-0.556	0.556
CHELPG
AIM
ESP

<r²>	154.690
(<r²>)^1/2	12.437

All results from a given calculation for SOF4 (Sulfur tetrafluoride oxide)

using model chemistry: PBEPBE/STO-3G

States and conformations

All results from a given calculation for SOF₄ (Sulfur tetrafluoride oxide)