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	hartrees
Energy at 0K	-872.902114
Energy at 298.15K	-872.905555
HF Energy	-872.902114
Nuclear repulsion energy	408.582014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1347	1305	215.80
2	A₁	756	732	55.59
3	A₁	576	558	3.34
4	A₁	533	516	23.79
5	A₁	160	155	0.00
6	A₂	525	509	0.00
7	B₁	882	854	251.63
8	B₁	526	509	17.30
9	B₁	248	240	0.07
10	B₂	818	792	466.46
11	B₂	600	581	26.80
12	B₂	520	503	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.140
O2	0.000	0.000	1.568
F3	0.000	1.607	-0.084
F4	0.000	-1.607	-0.084
F5	1.308	0.000	-0.737
F6	-1.308	0.000	-0.737

	S1	O2	F3	F4	F5	F6
S1		1.4284	1.6225	1.6225	1.5747	1.5747
O2	1.4284		2.3050	2.3050	2.6501	2.6501
F3	1.6225	2.3050		3.2140	2.1725	2.1725
F4	1.6225	2.3050	3.2140		2.1725	2.1725
F5	1.5747	2.6501	2.1725	2.1725		2.6169
F6	1.5747	2.6501	2.1725	2.1725	2.6169

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	97.938	O2	S1	F4	97.938
O2	S1	F5	123.808	O2	S1	F6	123.808
F3	S1	F4	164.124	F3	S1	F5	85.593
F3	S1	F6	85.593	F4	S1	F5	85.593
F4	S1	F6	85.593	F5	S1	F6	112.383

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

using model chemistry: TPSSh/cc-pVTZ

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	1.048
2	O	-0.324
3	F	-0.226
4	F	-0.226
5	F	-0.136
6	F	-0.136

	x	y	z	Total
	0.000	0.000	-1.046	1.046
CHELPG
AIM
ESP

<r²>	130.934
(<r²>)^1/2	11.443

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

using model chemistry: TPSSh/cc-pVTZ

States and conformations

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