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	hartrees
Energy at 0K	-4637.395672
Energy at 298.15K	-4637.392032
HF Energy	-4637.395672
Nuclear repulsion energy	276.118471

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	-1.091
Se2	0.000	0.000	1.059

	As1	Se2
As1		2.1503
Se2	2.1503

Number	Element	Mulliken	CHELPG	AIM	ESP
1	As	0.131
2	Se	-0.131

	x	y	z	Total
	0.000	0.000	-0.798	0.798
CHELPG
AIM
ESP

All results from a given calculation for AsSe (Arsenic monoselenide)

using model chemistry: TPSSh/cc-pVTZ

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>	99.587
(<r²>)^1/2	9.979