scripts/cif_cod_check: tests/cases/cif_cod_check_116.inp data_2020314: NOTE, the provided and computed checksums of the '_shelx_res_file' SHELX data item do not match ('99880' vs. '97148').
scripts/cif_cod_check: tests/cases/cif_cod_check_116.inp: NOTE, 1 NOTE(s) encountered.
