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	hartrees
Energy at 0K	-497.410142
Energy at 298.15K	-497.409875
HF Energy	-496.969906
Nuclear repulsion energy	47.161592

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.582
F2	0.000	0.000	-1.034

	S1	F2
S1		1.6159
F2	1.6159

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

using model chemistry: CCSD(T)/aug-cc-pVTZ

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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