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	hartrees
Energy at 0K	-639.420971
Energy at 298.15K	-639.420888
HF Energy	-639.420971
Nuclear repulsion energy	54.330461

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	-1.118
S2	0.000	0.000	0.908

	Al1	S2
Al1		2.0259
S2	2.0259

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Al	0.452
2	S	-0.452

	z	Total
	-5.036	5.036
CHELPG	-5.494	5.494
AIM	3.083	3.084
ESP	-6.203	6.203

All results from a given calculation for AlS (Aluminum sulfide)

using model chemistry: HF/6-31G*

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>	44.879
(<r²>)^1/2	6.699