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	hartrees
Energy at 0K	-872.872980
Energy at 298.15K	-872.876112
HF Energy	-872.872980
Nuclear repulsion energy	400.214738

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1273	1269	184.78
2	A₁	679	677	57.22
3	A₁	523	521	3.72
4	A₁	495	494	16.28
5	A₁	138	137	0.00
6	A₂	492	490	0.00
7	B₁	798	795	238.08
8	B₁	490	489	10.66
9	B₁	235	234	0.00
10	B₂	746	743	430.39
11	B₂	560	558	11.09
12	B₂	485	484	0.04

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.145
O2	0.000	0.000	1.590
F3	0.000	1.641	-0.097
F4	0.000	-1.641	-0.097
F5	1.348	0.000	-0.739
F6	-1.348	0.000	-0.739

	S1	O2	F3	F4	F5	F6
S1		1.4447	1.6584	1.6584	1.6127	1.6127
O2	1.4447		2.3530	2.3530	2.6915	2.6915
F3	1.6584	2.3530		3.2813	2.2188	2.2188
F4	1.6584	2.3530	3.2813		2.2188	2.2188
F5	1.6127	2.6915	2.2188	2.2188		2.6966
F6	1.6127	2.6915	2.2188	2.2188	2.6966

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	98.390	O2	S1	F4	98.390
O2	S1	F5	123.275	O2	S1	F6	123.275
F3	S1	F4	163.220	F3	S1	F5	85.408
F3	S1	F6	85.408	F4	S1	F5	85.408
F4	S1	F6	85.408	F5	S1	F6	113.449

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

using model chemistry: BLYP/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	1.092
2	O	-0.315
3	F	-0.235
4	F	-0.235
5	F	-0.153
6	F	-0.153

	x	y	z	Total
	0.000	0.000	-0.836	0.836
CHELPG
AIM
ESP

<r²>	135.789
(<r²>)^1/2	11.653

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

using model chemistry: BLYP/cc-pVTZ

States and conformations

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