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	hartrees
Energy at 0K	-871.744830
Energy at 298.15K	-871.747226
HF Energy	-871.469131
Nuclear repulsion energy	370.949079

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1030	1030	112.50
2	A₁	615	615	31.56
3	A₁	538	538	0.03
4	A₁	379	379	28.78
5	A₁	104	104	0.04
6	A₂	369	369	0.00
7	B₁	759	759	137.56
8	B₁	374	374	21.51
9	B₁	210	210	0.22
10	B₂	787	787	220.65
11	B₂	415	415	25.25
12	B₂	348	348	1.30

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.165
O2	0.000	0.000	1.750
F3	0.000	1.738	-0.146
F4	0.000	-1.738	-0.146
F5	1.476	0.000	-0.778
F6	-1.476	0.000	-0.778

	S1	O2	F3	F4	F5	F6
S1		1.5855	1.7659	1.7659	1.7520	1.7520
O2	1.5855		2.5727	2.5727	2.9282	2.9282
F3	1.7659	2.5727		3.4766	2.3666	2.3666
F4	1.7659	2.5727	3.4766		2.3666	2.3666
F5	1.7520	2.9282	2.3666	2.3666		2.9525
F6	1.7520	2.9282	2.3666	2.3666	2.9525

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	100.148	O2	S1	F4	100.148
O2	S1	F5	122.580	O2	S1	F6	122.580
F3	S1	F4	159.704	F3	S1	F5	84.556
F3	S1	F6	84.556	F4	S1	F5	84.556
F4	S1	F6	84.556	F5	S1	F6	114.839

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

using model chemistry: B2PLYP/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	1.650
2	O	-0.436
3	F	-0.327
4	F	-0.327
5	F	-0.280
6	F	-0.280

	x	y	z	Total
	0.000	0.000	-0.114	0.114
CHELPG
AIM
ESP

<r²>	155.418
(<r²>)^1/2	12.467

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

using model chemistry: B2PLYP/6-31G

States and conformations

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