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Input optionsThe whole input file for NMR uses one block key NMR, with several (optional) sub keys, each having a series of options. NMR Out OutOptions Calc CalcOptions U1K U1KOptions Nuc NucOptions Atoms AtomsOptions Ghosts GhostsOptions Analysis AnalysisOptions EndOUT CALC U1K NUC ATOMS GHOSTS ANALYSIS | |