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	hartrees
Energy at 0K	-3159.037186
Energy at 298.15K	-3159.040696
Nuclear repulsion energy	123.962581

Atom	x (Å)	y (Å)	z (Å)
K1	0.000	0.000	-1.840
Br2	0.000	0.000	0.999

	K1	Br2
K1		2.8388
Br2	2.8388

Number	Element	Mulliken	CHELPG	AIM	ESP
1	K	0.534
2	Br	-0.534

	x	y	z	Total
	0.000	0.000	-10.020	10.020
CHELPG
AIM
ESP

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

using model chemistry: B3LYP/3-21G*

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