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	hartrees
Energy at 0K	-3170.903326
Energy at 298.15K	-3170.906801
Nuclear repulsion energy	120.067036

Atom	x (Å)	y (Å)	z (Å)
K1	0.000	0.000	-1.900
Br2	0.000	0.000	1.031

	K1	Br2
K1		2.9309
Br2	2.9309

Number	Element	Mulliken	CHELPG	AIM	ESP
1	K	0.687
2	Br	-0.687

	x	y	z	Total
	0.000	0.000	-11.271	11.271
CHELPG
AIM
ESP

All results from a given calculation for KBr (Potassium Bromide)

using model chemistry: PBEPBE/6-31G

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>	0.000
(<r²>)^1/2	0.000