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	hartrees
Energy at 0K	-672.188489
Energy at 298.15K
HF Energy	-671.378089
Nuclear repulsion energy	197.413191

Atom	x (Å)	y (Å)	z (Å)
S1	0.243	0.350	0.000
O2	-1.034	0.928	0.000
F3	0.243	-0.723	1.126
F4	0.243	-0.723	-1.126

	S1	O2	F3	F4
S1		1.4026	1.5556	1.5556
O2	1.4026		2.3724	2.3724
F3	1.5556	2.3724		2.2528
F4	1.5556	2.3724	2.2528

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	F3	106.529		O2	S1	F4	106.529
F3	S1	F4	92.792

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

using model chemistry: CID/aug-cc-pV(T+d)Z

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: CID/aug-cc-pV(T+d)Z

States and conformations

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