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	hartrees
Energy at 0K	-497.813770
Energy at 298.15K	-497.813531
HF Energy	-497.813770
Nuclear repulsion energy	47.680469

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.575
F2	0.000	0.000	-1.023

	S1	F2
S1		1.5982
F2	1.5982

Number	Element	Mulliken	CHELPG	AIM	ESP
1	S	0.369
2	F	-0.369

	x	y	z	Total
	0.000	0.000	0.720	0.720
CHELPG
AIM
ESP

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

using model chemistry: HSEh1PBE/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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<r²>	25.729
(<r²>)^1/2	5.072