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	hartrees
Energy at 0K	-872.043227
Energy at 298.15K	-872.046462
HF Energy	-872.043227
Nuclear repulsion energy	400.709477

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1302	1285	185.52
2	A₁	716	706	45.12
3	A₁	581	573	1.86
4	A₁	499	492	19.75
5	A₁	130	129	0.01
6	A₂	499	493	0.00
7	B₁	856	844	219.98
8	B₁	499	492	14.54
9	B₁	256	253	0.10
10	B₂	844	832	373.11
11	B₂	560	553	19.45
12	B₂	477	470	0.18

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.145
O2	0.000	0.000	1.597
F3	0.000	1.623	-0.119
F4	0.000	-1.623	-0.119
F5	1.367	0.000	-0.720
F6	-1.367	0.000	-0.720

	S1	O2	F3	F4	F5	F6
S1		1.4526	1.6444	1.6444	1.6176	1.6176
O2	1.4526		2.3619	2.3619	2.6903	2.6903
F3	1.6444	2.3619		3.2465	2.2059	2.2059
F4	1.6444	2.3619	3.2465		2.2059	2.2059
F5	1.6176	2.6903	2.2059	2.2059		2.7347
F6	1.6176	2.6903	2.2059	2.2059	2.7347

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	99.207	O2	S1	F4	99.207
O2	S1	F5	122.295	O2	S1	F6	122.295
F3	S1	F4	161.586	F3	S1	F5	85.096
F3	S1	F6	85.096	F4	S1	F5	85.096
F4	S1	F6	85.096	F5	S1	F6	115.409

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

using model chemistry: PBEPBEultrafine/6-31G**

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	1.348
2	O	-0.358
3	F	-0.281
4	F	-0.281
5	F	-0.214
6	F	-0.214

	x	y	z	Total
	0.000	0.000	-0.945	0.945
CHELPG
AIM
ESP

<r²>	134.862
(<r²>)^1/2	11.613

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

using model chemistry: PBEPBEultrafine/6-31G**

States and conformations

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