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	hartrees
Energy at 0K	-2476.280204
Energy at 298.15K
HF Energy	-2476.280204
Nuclear repulsion energy	85.440347

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.321
O2	0.000	0.000	-1.364

	Se1	O2
Se1		1.6846
O2	1.6846

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Se	0.549
2	O	-0.549

	x	y	z	Total
	0.000	0.000	1.985	1.985
CHELPG
AIM
ESP

All results from a given calculation for SeO (Selenium monoxide)

using model chemistry: PBEPBE/daug-cc-pVDZ

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>	33.135
(<r²>)^1/2	5.756