scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_chemical_formula_sum' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_publ_section_title' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_journal_name_full' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_journal_year' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_journal_volume' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_journal_page_first' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, data item '_cell_formula_units_Z' value 'none' is not a natural number -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, summary formula could not be calculated -- cell length data item '_cell_length_c' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, unit cell summary formula could not be calculated -- cell length data item '_cell_length_c' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, value of 'Robs' ('small') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, value of 'a' ('not measured') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, value of 'duplicateof' ('none found') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, value of 'file' ('non_numeric') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric: WARNING, value of 'wavelength' ('time-of-flight') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_chemical_formula_sum' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_publ_section_title' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_journal_name_full' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_journal_year' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_journal_volume' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_journal_page_first' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, data item '_cell_formula_units_Z' was not found -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_alpha' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_beta' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_gamma' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, summary formula could not be calculated -- neither symmetry operation data item values, nor Hall space group name, nor Hermann-Mauguin space group name could be processed to acquire symmetry operations.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_alpha' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_beta' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, cell angle data item '_cell_angle_gamma' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, unit cell summary formula could not be calculated -- neither symmetry operation data item values, nor Hall space group name, nor Hermann-Mauguin space group name could be processed to acquire symmetry operations.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'a' ('inf') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'b' ('+inf') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'c' ('-inf') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'celltemp' ('infinity') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'diffrtemp' ('+infinity') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'file' ('non_numeric_inf') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_inf: WARNING, value of 'wavelength' ('-infinity') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_chemical_formula_sum' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_publ_section_title' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_journal_name_full' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_journal_year' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_journal_volume' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_journal_page_first' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, data item '_cell_formula_units_Z' was not found -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_alpha' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_beta' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_gamma' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, summary formula could not be calculated -- neither symmetry operation data item values, nor Hall space group name, nor Hermann-Mauguin space group name could be processed to acquire symmetry operations.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_alpha' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_beta' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, cell angle data item '_cell_angle_gamma' was not found -- taking default value 90 degrees.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, unit cell summary formula could not be calculated -- neither symmetry operation data item values, nor Hall space group name, nor Hermann-Mauguin space group name could be processed to acquire symmetry operations.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, value of 'a' ('NaN') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, value of 'b' ('+nan') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, value of 'c' ('-naN') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_non_numeric_nan: WARNING, value of 'file' ('non_numeric_nan') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_chemical_formula_sum' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_publ_section_title' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_journal_name_full' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_journal_year' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_journal_volume' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_journal_page_first' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, data item '_cell_formula_units_Z' value '-2' is not a natural number -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, summary formula could not be calculated -- cell length data item '_cell_length_b' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, unit cell summary formula could not be calculated -- cell length data item '_cell_length_b' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, value of 'a' ('-5') is negative, while it must be unsigned -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, value of 'duplicateof' ('-1') is negative, while it must be unsigned -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, value of 'file' ('signed') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_signed: WARNING, value of 'wavelength' ('-5000') is negative, while it must be unsigned -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_chemical_formula_sum' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_publ_section_title' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_journal_name_full' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_journal_year' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_journal_volume' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_journal_page_first' is absent.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, data item '_cell_formula_units_Z' was not found -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, summary formula could not be calculated -- cell length data item '_cell_length_a' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, unit cell summary formula could not be calculated -- cell length data item '_cell_length_a' was not found.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, value of 'acce_code' ('A VERY LONG CODE') is longer than allowed (16 > 6) and may be corrupted upon casting -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, value of 'file' ('overflow') does not seem to be numeric -- value will be treated as undefined.
scripts/cif2cod: tests/cases/cif2cod_044.inp data_overflow: WARNING, value of 'issue' ('a value clearly too long') is longer than allowed (24 > 10) and may be corrupted upon casting -- value will be treated as undefined.
b 3
nel 0
formula ?
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nel 0
formula ?
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nel 0
formula ?
flags 
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nel 0
formula ?
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nel 0
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text \n\n\n(issue a value clearly too long)\n()\n
