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	hartrees
Energy at 0K	-7772.875446
Energy at 298.15K
HF Energy	-7771.724214
Nuclear repulsion energy	830.565756

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.630
Br2	0.000	1.790	-0.042
Br3	1.550	-0.895	-0.042
Br4	-1.550	-0.895	-0.042

	N1	Br2	Br3	Br4
N1		1.9123	1.9123	1.9123
Br2	1.9123		3.1009	3.1009
Br3	1.9123	3.1009		3.1009
Br4	1.9123	3.1009	3.1009

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	N1	Br3	108.346		Br2	N1	Br4	108.346
Br3	N1	Br4	108.346

All results from a given calculation for NBr₃ (Nitrogen Tribromide)

using model chemistry: CCSD(T)=FULL/aug-cc-pVTZ

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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All results from a given calculation for NBr3 (Nitrogen Tribromide)

using model chemistry: CCSD(T)=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for NBr₃ (Nitrogen Tribromide)