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	hartrees
Energy at 0K	-673.019432
Energy at 298.15K	-673.022557
HF Energy	-673.019432
Nuclear repulsion energy	185.733617

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1231	1221	115.38
2	A'	748	743	125.57
3	A'	451	448	19.22
4	A'	300	298	2.70
5	A"	703	697	152.11
6	A"	329	327	3.47

Atom	x (Å)	y (Å)	z (Å)
S1	0.252	0.369	0.000
O2	-1.072	1.004	0.000
F3	0.252	-0.774	1.207
F4	0.252	-0.774	-1.207

	S1	O2	F3	F4
S1		1.4682	1.6628	1.6628
O2	1.4682		2.5241	2.5241
F3	1.6628	2.5241		2.4139
F4	1.6628	2.5241	2.4139

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	F3	107.285		O2	S1	F4	107.285
F3	S1	F4	93.078

All results from a given calculation for F₂SO (Thionyl Fluoride)

using model chemistry: BLYP/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	0.991
2	O	-0.402
3	F	-0.295
4	F	-0.295

	x	y	z	Total
	1.523	0.606	0.000	1.639
CHELPG
AIM
ESP

	x	y	z
x	3.037	-0.736	0.000
y	-0.736	3.337	0.000
z	0.000	0.000	3.261

<r²>	75.869
(<r²>)^1/2	8.710

All results from a given calculation for F2SO (Thionyl Fluoride)

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

States and conformations

All results from a given calculation for F₂SO (Thionyl Fluoride)