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	hartrees
Energy at 0K	-2476.865374
Energy at 298.15K
HF Energy	-2476.865374
Nuclear repulsion energy	86.997930

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.315
O2	0.000	0.000	-1.339

	Se1	O2
Se1		1.6545
O2	1.6545

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Se	0.625
2	O	-0.625

	x	y	z	Total
	0.000	0.000	2.109	2.109
CHELPG
AIM
ESP

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

using model chemistry: mPW1PW91/aug-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>	32.394
(<r²>)^1/2	5.692