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	hartrees
Energy at 0K	-225.533626
Energy at 298.15K
HF Energy	-225.533626
Nuclear repulsion energy	81.717834

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.583
O2	0.000	1.106	-0.231
O3	0.000	-1.106	-0.231
H4	-0.914	1.190	-0.485
H5	0.914	-1.190	-0.485

	O1	O2	O3	H4	H5
O1		1.3730	1.3730	1.8413	1.8413
O2	1.3730		2.2124	0.9522	2.4843
O3	1.3730	2.2124		2.4843	0.9522
H4	1.8413	0.9522	2.4843		3.0007
H5	1.8413	2.4843	0.9522	3.0007

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	O2	H4	103.233		O1	O3	H5	103.233
O2	O1	O3	107.354

Number	Element	Mulliken
1	O	-0.084
2	O	-0.421
3	O	-0.421
4	H	0.463
5	H	0.463

All results from a given calculation for H₂O₃ (Hydrogen trioxide)

using model chemistry: HF/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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	x	y	z
x	1.656	-0.355	0.000
y	-0.355	2.915	0.000
z	0.000	0.000	1.600

<r²>	37.944
(<r²>)^1/2	6.160

All results from a given calculation for H2O3 (Hydrogen trioxide)

using model chemistry: HF/6-31G*

States and conformations

All results from a given calculation for H₂O₃ (Hydrogen trioxide)