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	hartrees
Energy at 0K	-553.891109
Energy at 298.15K	-553.891693
HF Energy	-553.891109
Nuclear repulsion energy	41.693152

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	-1.324
S2	0.000	0.000	0.910

	Na1	S2
Na1		2.2338
S2	2.2338

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	0.526
2	S	-0.526

	x	y	z	Total
	0.000	0.000	-7.061	7.061
CHELPG
AIM
ESP

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

using model chemistry: B3PW91/STO-3G

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>	41.124
(<r²>)^1/2	6.413