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	hartrees
Energy at 0K	-671.899451
Energy at 298.15K	-671.902823
HF Energy	-671.192650
Nuclear repulsion energy	189.039569

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1360	1301	178.17
2	A'	826	790	183.49
3	A'	515	492	34.19
4	A'	361	345	6.75
5	A"	775	742	200.82
6	A"	377	360	6.08

Atom	x (Å)	y (Å)	z (Å)
S1	0.250	0.372	0.000
O2	-1.063	0.973	0.000
F3	0.250	-0.763	1.178
F4	0.250	-0.763	-1.178

	S1	O2	F3	F4
S1		1.4449	1.6356	1.6356
O2	1.4449		2.4756	2.4756
F3	1.6356	2.4756		2.3550
F4	1.6356	2.4756	2.3550

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	F3	106.794		O2	S1	F4	106.794
F3	S1	F4	92.096

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

using model chemistry: CCD/cc-pVDZ

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

using model chemistry: CCD/cc-pVDZ

States and conformations

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