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	hartrees
Energy at 0K	-2678.193412
Energy at 298.15K	-2678.191080
HF Energy	-2678.193412
Nuclear repulsion energy	117.286435

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	-1.521
Se2	0.000	0.000	0.626

	Si1	Se2
Si1		2.1476
Se2	2.1476

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Si	0.267
2	Se	-0.267

	x	y	z	Total
	0.000	0.000	-1.267	1.267
CHELPG
AIM
ESP

All results from a given calculation for SiSe (Silicon Monoselenide)

using model chemistry: B3LYPultrafine/3-21G

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>	65.511
(<r²>)^1/2	8.094