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	hartrees
Energy at 0K	-100.749669
Energy at 298.15K	-100.749869
HF Energy	-100.749669
Nuclear repulsion energy	21.613423

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2887	2786	8.60
2	Σ	1839	1775	62.98
3	Π	772	745	11.11
3	Π	772	745	11.10

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.605
H2	0.000	0.000	-1.774
O3	0.000	0.000	0.600

	B1	H2	O3
B1		1.1694	1.2049
H2	1.1694		2.3743
O3	1.2049	2.3743

Number	Element	Mulliken
1	B	0.284
2	H	-0.008
3	O	-0.276

All results from a given calculation for HBO (Boron hydride oxide)

using model chemistry: TPSSh/aug-cc-pVTZ

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	2.175	-0.000	0.000
y	-0.000	2.176	0.000
z	0.000	0.000	3.214

<r²>	14.668
(<r²>)^1/2	3.830