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	hartrees
Energy at 0K	-225.656931
Energy at 298.15K
HF Energy	-225.656931
Nuclear repulsion energy	82.274564

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.573
O2	0.000	1.101	-0.228
O3	0.000	-1.101	-0.228
H4	-0.906	1.209	-0.470
H5	0.906	-1.209	-0.470

	O1	O2	O3	H4	H5
O1		1.3617	1.3617	1.8361	1.8361
O2	1.3617		2.2017	0.9441	2.4929
O3	1.3617	2.2017		2.4929	0.9441
H4	1.8361	0.9441	2.4929		3.0215
H5	1.8361	2.4929	0.9441	3.0215

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	O2	H4	104.086		O1	O3	H5	104.086
O2	O1	O3	107.887

Number	Element	Mulliken
1	O	-0.025
2	O	-0.255
3	O	-0.255
4	H	0.268
5	H	0.268

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

using model chemistry: HF/cc-pVQZ

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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	x	y	z
x	2.081	-0.305	0.000
y	-0.305	3.383	0.000
z	0.000	0.000	2.121

<r²>	37.735
(<r²>)^1/2	6.143

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

using model chemistry: HF/cc-pVQZ

States and conformations

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