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	hartrees
Energy at 0K	-2626.228015
Energy at 298.15K	-2626.230833
HF Energy	-2626.228015
Nuclear repulsion energy	67.636070

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.597
Br2	0.000	0.000	0.319

	N1	Br2
N1		1.9169
Br2	1.9169

Number	Element	Mulliken	CHELPG	AIM	ESP
1	N	-0.181
2	Br	0.181

	x	y	z	Total
	0.000	0.000	0.516	0.516
CHELPG
AIM
ESP

All results from a given calculation for NBr (nitrogen monobromide)

using model chemistry: M06-2X/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>	36.395
(<r²>)^1/2	6.033