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	hartrees
Energy at 0K	-2624.273802
Energy at 298.15K	-2624.276632
HF Energy	-2624.273802
Nuclear repulsion energy	70.954662

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.523
Br2	0.000	0.000	0.305

	N1	Br2
N1		1.8272
Br2	1.8272

Number	Element	Mulliken	CHELPG	AIM	ESP
1	N	0.017
2	Br	-0.017

	x	y	z	Total
	0.000	0.000	0.618	0.618
CHELPG
AIM
ESP

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

using model chemistry: ROHF/6-31+G**

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>	34.497
(<r²>)^1/2	5.873