Prediction of NMR spectra, particularly C NMR spectra is a common task encountered in structural elucidation and revision. Although modern computational tools allow fast GIAO-DFT NMR prediction, a complete cycle workflow that automates the task to start with a ChemDraw™ file and orchestrates the required computations, is not generally available using open-source tools. A major advance toward this goal is the CENSO program, which enables direct processing of CREST conformer ensembles and plotting of Boltzmann-weighted spectra. 48