I.B.3. (II.A.2.)

All data (experiment and calculated) in the CCCBDB for HBO (Boron hydride oxide)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		269
	Energy 298.15K		258
	Atomization Enthalpy 298.15K	x	253	x
	Atomization Enthalpy 0K	x	254	x
	Entropy (298.15K)	x	219	x
	Entropy at any temperature		219
	Integrated Heat Capacity	x	219	x
	Heat Capacity (Cp)	x	219	x
	Nuclear Repulsion Energy		224
	HOMO-LUMO Energies		217
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	187
	Internal Coordinates	x	187	x
	Products of moments of inertia	x	198	x
	Rotational Constants	x	200	x
	Point Group		202
Vibrations	Vibrational Frequencies	x	204	x
	Vibrational Intensities		193
	Zero-point energies	x	204	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		172
	Dipole		158
	Quadrupole		151
	Polarizability		143
Other results	Spin		0
	Number of basis functions		28
	Diagnostics		6
	Conformations		1