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	hartrees
Energy at 0K	-560.289124
Energy at 298.15K	-560.289571
HF Energy	-560.202456
Nuclear repulsion energy	37.261358

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.481
S2	0.000	0.000	1.018

	Na1	S2
Na1		2.4995
S2	2.4995

All results from a given calculation for NaS (Sodium sulfide)

using model chemistry: B2PLYP=FULL/aug-cc-pV(T+d)Z

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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