These configurations have three sequential hydrogen-bond networks connecting two water molecules in pose D. The four systems consisting of the complex and the first solvation shell are here employed to understand how the change in the electronic structure of the complex affects the solute-solvent and solvent-solvent interactions at the equilibrium geometries. We note that, even though these four frames will obviously not represent all configurations in the liquid phase, our molecular dynamics simulations indicates that the hydrogen bond network is very well preserved in the liquid phase, and thus, the configurations we have chosen to investigate are representative of configurations that are visited very often, during thermal sampling (vide infra).