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	hartrees
Energy at 0K	-699.854212
Energy at 298.15K	-699.854929
HF Energy	-699.854212
Nuclear repulsion energy	39.251380

Atom	x (Å)	y (Å)	z (Å)
K1	0.000	0.000	0.741
F2	0.000	0.000	-1.564

	K1	F2
K1		2.3054
F2	2.3054

Number	Element	Mulliken	CHELPG	AIM	ESP
1	K	0.866
2	F	-0.866

	x	y	z	Total
	0.000	0.000	9.858	9.858
CHELPG
AIM
ESP

All results from a given calculation for KF (Potassium Fluoride)

using model chemistry: B3LYP/TZVP

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>	44.212
(<r²>)^1/2	6.649