Accuracy
germanium sulfide
3914 Germanium sulfide
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Geometry predicted using PM7
Dipole: 2.0 Debye, REF: K. P. Huber, G. Herzberg, "Molecular Spectra and Molecular Structure," IV. "Constants for Diatomic Molecules," Van Nostrand, Reinhold, New York, (1979).
SHIFT=30 SCFCRT=1.D-11 PM7
Germanium sulfide
D=2.0 DR=HH1979
Ge 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
S 2.04288000 +1 0.0000000 +0 0.0000000 +0 1 0 0