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	hartrees
Energy at 0K	-746.024217
Energy at 298.15K	-746.027356
HF Energy	-746.024217
Nuclear repulsion energy	293.511603

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1376	1242	227.57
2	A₁	959	866	129.26
3	A₁	597	539	52.38
4	A₁	408	368	0.05
5	A₂	402	363	0.00
6	B₁	1005	907	290.46
7	B₁	585	528	47.67
8	B₂	1614	1457	393.21
9	B₂	579	523	49.01

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.164
O2	0.000	1.237	0.812
O3	0.000	-1.237	0.812
F4	1.130	0.000	-0.868
F5	-1.130	0.000	-0.868

	S1	O2	O3	F4	F5
S1		1.3959	1.3959	1.5306	1.5306
O2	1.3959		2.4733	2.3723	2.3723
O3	1.3959	2.4733		2.3723	2.3723
F4	1.5306	2.3723	2.3723		2.2608
F5	1.5306	2.3723	2.3723	2.2608

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	124.724	O2	S1	F4	108.225
O2	S1	F5	108.225	O3	S1	F4	108.225
O3	S1	F5	108.225	F4	S1	F5	95.214

All results from a given calculation for SO₂F₂ (Sulfuryl fluoride)

using model chemistry: HF/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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Number	Element	Mulliken
1	S	1.763
2	O	-0.542
3	O	-0.542
4	F	-0.340
5	F	-0.340

	x	y	z	Total
	0.000	0.000	-1.303	1.303
CHELPG
AIM
ESP

<r²>	93.185
(<r²>)^1/2	9.653

All results from a given calculation for SO2F2 (Sulfuryl fluoride)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for SO₂F₂ (Sulfuryl fluoride)