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	hartrees
Energy at 0K	-896.407163
Energy at 298.15K	-896.410552
HF Energy	-894.782247
Nuclear repulsion energy	415.795293

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	893	860
2	B₁	458	441
3	E	861	829
4	E	861	829
5	E	647	623
6	E	603	580
7	E	553	533
7	E	520	501
8	E	520	501
8	E	356	343
9	E	356	343
9	E	239	230

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.203
F2	0.000	0.000	-1.351
F3	0.000	1.610	0.247
F4	-1.610	0.000	0.247
F5	0.000	-1.610	0.247
F6	1.610	0.000	0.247

	S1	F2	F3	F4	F5	F6
S1		1.5543	1.6105	1.6105	1.6105	1.6105
F2	1.5543		2.2686	2.2686	2.2686	2.2686
F3	1.6105	2.2686		2.2767	3.2197	2.2767
F4	1.6105	2.2686	2.2767		2.2767	3.2197
F5	1.6105	2.2686	3.2197	2.2767		2.2767
F6	1.6105	2.2686	2.2767	3.2197	2.2767

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	91.570	F2	S1	F4	91.570
F2	S1	F5	91.570	F2	S1	F6	91.570
F3	S1	F4	89.957	F3	S1	F5	176.860
F3	S1	F6	89.957	F4	S1	F5	89.957
F4	S1	F6	176.860	F5	S1	F6	89.957

All results from a given calculation for SF₅ (Sulfur pentafluoride)

using model chemistry: MP4=FULL/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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HF vs MP2 Bad vib. Calc. vs exp. 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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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All results from a given calculation for SF5 (Sulfur pentafluoride)

using model chemistry: MP4=FULL/cc-pVTZ

States and conformations

All results from a given calculation for SF₅ (Sulfur pentafluoride)