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	hartrees
Energy at 0K	-672.057712
Energy at 298.15K	-672.060938
HF Energy	-671.230458
Nuclear repulsion energy	186.395418

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	1247	1211
2	A'	769	747
3	A'	471	457
4	A'	326	316
5	A"	721	700
6	A"	348	338

Atom	x (Å)	y (Å)	z (Å)
S1	0.255	0.378	0.000
O2	-1.084	0.978	0.000
F3	0.255	-0.771	1.196
F4	0.255	-0.771	-1.196

	S1	O2	F3	F4
S1		1.4670	1.6584	1.6584
O2	1.4670		2.5060	2.5060
F3	1.6584	2.5060		2.3923
F4	1.6584	2.5060	2.3923

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	F3	106.444		O2	S1	F4	106.444
F3	S1	F4	92.316

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

using model chemistry: CCSD(T)=FULL/aug-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: CCSD(T)=FULL/aug-cc-pVDZ

States and conformations

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