data_goodness_of_fit_gt
_space_group_name_H-M_alt       'P 1'
_space_group_name_Hall          'P 1'
_journal_name_full              'Fake journal used for CIF software testing purposes'
_publ_section_title             'Fake title used for CIF software testing purposes'
_journal_year                   1970
_journal_volume                 1970
_journal_page_first             1
_cell_formula_units_Z           1
_cell_length_a                  5
_cell_length_b                  5
_cell_length_c                  5
_cell_angle_alpha               90
_cell_angle_beta                90
_cell_angle_gamma               90
_chemical_formula_sum           H
_refine_ls_goodness_of_fit_all  1.239
_refine_ls_goodness_of_fit_gt   3.141
_refine_ls_goodness_of_fit_ref  1.166
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
H H 0.5 0.5 0.5

data_goodness_of_fit_obs
_space_group_name_H-M_alt       'P 1'
_space_group_name_Hall          'P 1'
_journal_name_full              'Fake journal used for CIF software testing purposes'
_publ_section_title             'Fake title used for CIF software testing purposes'
_journal_year                   1970
_journal_volume                 1970
_journal_page_first             1
_cell_formula_units_Z           1
_cell_length_a                  5
_cell_length_b                  5
_cell_length_c                  5
_cell_angle_alpha               90
_cell_angle_beta                90
_cell_angle_gamma               90
_chemical_formula_sum           H
_refine_ls_goodness_of_fit_all  1.239
_refine_ls_goodness_of_fit_obs  1.618
_refine_ls_goodness_of_fit_ref  1.166
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
H H 0.5 0.5 0.5

# When both the '_refine_ls_goodness_of_fit_gt' and
# the '_refine_ls_goodness_of_fit_obs' data items are
# provided in the loop, the value of the '_refine_ls_goodness_of_fit_gt'
# item should be used
data_goodness_of_fit_both
_space_group_name_H-M_alt       'P 1'
_space_group_name_Hall          'P 1'
_journal_name_full              'Fake journal used for CIF software testing purposes'
_publ_section_title             'Fake title used for CIF software testing purposes'
_journal_year                   1970
_journal_volume                 1970
_journal_page_first             1
_cell_formula_units_Z           1
_cell_length_a                  5
_cell_length_b                  5
_cell_length_c                  5
_cell_angle_alpha               90
_cell_angle_beta                90
_cell_angle_gamma               90
_chemical_formula_sum           H
_refine_ls_goodness_of_fit_all  1.239
_refine_ls_goodness_of_fit_gt   3.141
_refine_ls_goodness_of_fit_obs  1.618
_refine_ls_goodness_of_fit_ref  1.166
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
H H 0.5 0.5 0.5

data_goodness_of_fit_gt
_space_group_name_H-M_alt       'P 1'
_space_group_name_Hall          'P 1'
_journal_name_full              'Fake journal used for CIF software testing purposes'
_publ_section_title             'Fake title used for CIF software testing purposes'
_journal_year                   1970
_journal_volume                 1970
_journal_page_first             1
_cell_formula_units_Z           1
_cell_length_a                  5
_cell_length_b                  5
_cell_length_c                  5
_cell_angle_alpha               90
_cell_angle_beta                90
_cell_angle_gamma               90
_chemical_formula_sum           H
_refine_ls_goodness_of_fit_all  1.239
_refine_ls_goodness_of_fit_ref  1.166
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
H H 0.5 0.5 0.5
