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	hartrees
Energy at 0K	-497.764804
Energy at 298.15K
HF Energy	-497.639059
Nuclear repulsion energy	47.502938

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.577
F2	0.000	0.000	-1.027

	S1	F2
S1		1.6041
F2	1.6041

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

using model chemistry: B2PLYP=FULLultrafine/6-31G(2df,p)

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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