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	hartrees
Energy at 0K	-497.752050
Energy at 298.15K	-497.751779
HF Energy	-497.651761
Nuclear repulsion energy	46.231342

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.593
F2	0.000	0.000	-1.055

	S1	F2
S1		1.6483
F2	1.6483

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

using model chemistry: B2PLYP=FULL/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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