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	hartrees
Energy at 0K	-2476.336954
Energy at 298.15K	-2476.334471
Nuclear repulsion energy	86.549863

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.317
O2	0.000	0.000	-1.346

	Se1	O2
Se1		1.6630
O2	1.6630

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Se	0.373
2	O	-0.373

	x	y	z	Total
	0.000	0.000	1.908	1.908
CHELPG
AIM
ESP

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

using model chemistry: PBEPBE/cc-pVQZ

States and conformations

State 1 (³Σ)

State 2 (¹?)

	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>	32.623
(<r²>)^1/2	5.712

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

using model chemistry: PBEPBE/cc-pVQZ

States and conformations

State 1 (3Σ)

State 2 (1?)

State 1 (³Σ)

State 2 (¹?)