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	hartrees
Energy at 0K	-2614.240353
Energy at 298.15K	-2614.243163
HF Energy	-2614.136507
Nuclear repulsion energy	66.713707

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.619
Br2	0.000	0.000	0.324

	N1	Br2
N1		1.9434
Br2	1.9434

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

using model chemistry: CISD/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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