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	hartrees
Energy at 0K	-2731.991881
Energy at 298.15K	-2731.995243
HF Energy	-2731.833554
Nuclear repulsion energy	80.269277

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.927
Br2	0.000	0.000	0.606

	Na1	Br2
Na1		2.5333
Br2	2.5333

All results from a given calculation for NaBr (Sodium Bromide)

using model chemistry: MP3=FULL/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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