Supplementary dataset in support of the manuscript "Influence of beta-Cyclodextrin Methylation on Host-Guest Complex Stability: A Theoretical Study of Intra- and Intermolecular Interactions as well as
Folders containing all calculated optimised atomic structures of Gd@C60(CF3)n in xyz format (Zip and tarred file) and their energies in Hartrees. Remove the .png extension before unpacking.
