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	hartrees
Energy at 0K	-150.743047
Energy at 298.15K
HF Energy	-150.743047
Nuclear repulsion energy	32.382509

Atom	x (Å)	y (Å)
O1	0.056	-0.604
O2	0.056	0.711
H3	-0.889	-0.863

	O1	O2	H3
O1		1.3149	0.9798
O2	1.3149		1.8361
H3	0.9798	1.8361

Number	Element	Mulliken
1	O	-0.284
2	O	-0.156
3	H	0.440

	x	y	z	Total
	-1.809	-1.392	0.000	2.282
CHELPG
AIM
ESP

All results from a given calculation for HO₂ (Hydroperoxy radical)

using model chemistry: PBE1PBE/6-31G*

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>	14.987
(<r²>)^1/2	3.871

All results from a given calculation for HO2 (Hydroperoxy radical)

using model chemistry: PBE1PBE/6-31G*

States and conformations

All results from a given calculation for HO₂ (Hydroperoxy radical)