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	hartrees
Energy at 0K	-497.283646
Energy at 298.15K	-497.283372
HF Energy	-496.924199
Nuclear repulsion energy	45.898120

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.598
F2	0.000	0.000	-1.062

	S1	F2
S1		1.6601
F2	1.6601

All results from a given calculation for SF (Monosulfur monofluoride)

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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