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	hartrees
Energy at 0K	-24.679181
Energy at 298.15K	-24.679169
HF Energy	-24.638555
Nuclear repulsion energy	3.927408

Atom	x (Å)	y (Å)	z (Å)
F1	0.000	0.000	0.094
H2	0.000	0.000	-0.849

	F1	H2
F1		0.9432
H2	0.9432

Number	Element	Mulliken	CHELPG	AIM	ESP
1	F	-0.448
2	H	0.448

	x	y	z
x	0.197	0.000	0.000
y	0.000	0.197	0.000
z	0.000	0.000	0.734

All results from a given calculation for HF (Hydrogen fluoride)

using model chemistry: B2PLYP/CEP-121G

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>	3.885
(<r²>)^1/2	1.971