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posted on 2024-09-10, 12:04 authored by Helen O. Leung, Mark Marshall
Cartesian coordinates of all atoms in the ab initio predicted optimized structures in Figure 4 and the two structures consistent with experimental spectroscopic constants in Figure 6 (Table S1), and observed transition frequencies with assignments and residuals (observed minus calculated) for three isotopologues of cis-1,2-difluoroethylene-HCl (Tables S2-S4).

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    Journal of Chemical Physics

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