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	hartrees
Energy at 0K	-2631.397219
Energy at 298.15K	-2631.395373
HF Energy	-2631.397219
Nuclear repulsion energy	136.925459

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.666
S2	0.000	0.000	-1.374

	As1	S2
As1		2.0406
S2	2.0406

Number	Element	Mulliken	CHELPG	AIM	ESP
1	As	0.041
2	S	-0.041

	x	y	z	Total
	0.000	0.000	1.219	1.219
CHELPG
AIM
ESP

All results from a given calculation for AsS (Arsenic monosulfide)

using model chemistry: PBEPBEultrafine/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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<r²>	64.211
(<r²>)^1/2	8.013