Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All data (experiment and calculated) in the CCCBDB for HSSSH (trisulfane)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		825
	Energy 298.15K		782
	Atomization Enthalpy 298.15K		0
	Atomization Enthalpy 0K		0
	Entropy (298.15K)		0
	Entropy at any temperature		0
	Integrated Heat Capacity		0
	Heat Capacity (Cp)		0
	Nuclear Repulsion Energy		821
	HOMO-LUMO Energies		782
	Barriers to Internal Rotation		523
Geometries	Cartesians	x	827
	Internal Coordinates	x	827	x
	Products of moments of inertia	x	807	x
	Rotational Constants	x	823	x
	Point Group		829
Vibrations	Vibrational Frequencies	fun.	819	x
	Vibrational Intensities		759
	Zero-point energies		819
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		10
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		513
	Dipole		616
	Quadrupole		562
	Polarizability		597
Other results	Spin		0
	Number of basis functions		32
	Conformations		2	x