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	hartrees
Energy at 0K	-4632.222305
Energy at 298.15K
HF Energy	-4632.129355
Nuclear repulsion energy	276.697722

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	-1.089
Se2	0.000	0.000	1.057

	As1	Se2
As1		2.1458
Se2	2.1458

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

using model chemistry: B2PLYP=FULLultrafine/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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