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

All data (experiment and calculated) in the CCCBDB for BO (boron monoxide)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		302
	Energy 298.15K		282
	Atomization Enthalpy 298.15K	x	268	x
	Atomization Enthalpy 0K	x	278	x
	Entropy (298.15K)	x	243	x
	Entropy at any temperature		243
	Integrated Heat Capacity	x	243	x
	Heat Capacity (Cp)	x	243	x
	Nuclear Repulsion Energy		252
	HOMO-LUMO Energies		241
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	209
	Internal Coordinates	x	209	x
	Products of moments of inertia	x	229	x
	Rotational Constants	x	232	x
	Point Group		234
Vibrations	Vibrational Frequencies	x	232	x
	Vibrational Intensities		214
	Zero-point energies	x	232	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		187
	Dipole		175
	Quadrupole		173
	Polarizability		146
Other results	Spin		182
	Number of basis functions		31
	Diagnostics		6
	Conformations		1