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	hartrees
Energy at 0K	-872.369078
Energy at 298.15K	-872.371403
HF Energy	-872.369078
Nuclear repulsion energy	370.824480

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1005	967	103.72
2	A₁	619	596	23.81
3	A₁	535	515	0.10
4	A₁	368	354	26.29
5	A₁	98	94	0.00
6	A₂	360	346	0.00
7	B₁	762	733	139.36
8	B₁	367	353	20.45
9	B₁	207	199	0.26
10	B₂	791	761	225.76
11	B₂	404	389	23.20
12	B₂	335	322	1.34

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.163
O2	0.000	0.000	1.751
F3	0.000	1.737	-0.155
F4	0.000	-1.737	-0.155
F5	1.484	0.000	-0.769
F6	-1.484	0.000	-0.769

	S1	O2	F3	F4	F5	F6
S1		1.5882	1.7657	1.7657	1.7521	1.7521
O2	1.5882		2.5790	2.5790	2.9243	2.9243
F3	1.7657	2.5790		3.4736	2.3652	2.3652
F4	1.7657	2.5790	3.4736		2.3652	2.3652
F5	1.7521	2.9243	2.3652	2.3652		2.9675
F6	1.7521	2.9243	2.3652	2.3652	2.9675

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	100.386	O2	S1	F4	100.386
O2	S1	F5	122.129	O2	S1	F6	122.129
F3	S1	F4	159.227	F3	S1	F5	84.498
F3	S1	F6	84.498	F4	S1	F5	84.498
F4	S1	F6	84.498	F5	S1	F6	115.743

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

using model chemistry: TPSSh/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	1.574
2	O	-0.428
3	F	-0.311
4	F	-0.311
5	F	-0.262
6	F	-0.262

	x	y	z	Total
	0.000	0.000	-0.201	0.201
CHELPG
AIM
ESP

<r²>	155.160
(<r²>)^1/2	12.456

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

using model chemistry: TPSSh/6-31G

States and conformations

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