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	hartrees
Energy at 0K	-671.196686
Energy at 298.15K	-671.200257
HF Energy	-671.196686
Nuclear repulsion energy	195.395527

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1451	1312	264.93
2	A'	911	824	247.75
3	A'	588	532	45.32
4	A'	414	374	8.52
5	A"	854	773	270.31
6	A"	429	388	9.19

Atom	x (Å)	y (Å)	z (Å)
S1	0.245	0.356	0.000
O2	-1.039	0.938	0.000
F3	0.245	-0.734	1.138
F4	0.245	-0.734	-1.138

	S1	O2	F3	F4
S1		1.4095	1.5761	1.5761
O2	1.4095		2.3954	2.3954
F3	1.5761	2.3954		2.2764
F4	1.5761	2.3954	2.2764

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	F3	106.576		O2	S1	F4	106.576
F3	S1	F4	92.469

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

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

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	1.615
2	O	-0.710
3	F	-0.453
4	F	-0.453

	x	y	z	Total
	2.172	0.606	0.000	2.255
CHELPG
AIM
ESP

	x	y	z
x	3.083	-0.590	0.000
y	-0.590	3.188	0.000
z	0.000	0.000	3.127

<r²>	70.650
(<r²>)^1/2	8.405

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

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

States and conformations

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