data_global
_chemical_name_mineral 'Macedonite'
loop_
_publ_author_name
'Cole S'
'Espenschied H'
_journal_name_full 'Journal of Physical Chemistry'
_journal_volume 41 
_journal_year 1937
_journal_page_first 445
_journal_page_last 451
_publ_section_title
;
 Lead titanate: crystal structure, temperature of formation, and
 specific gravity data
 _cod_database_code 1011028
;
_database_code_amcsd 0017934
_chemical_formula_sum 'Pb Ti O3'
_cell_length_a 4.000
_cell_length_b 4.211
_cell_length_c 3.875
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 65.271
_exptl_crystal_density_diffrn      7.711
_symmetry_space_group_name_H-M 'P m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,-y,z'
  '-x,y,-z'
  '-x,y,z'
  'x,-y,-z'
  'x,y,-z'
  '-x,-y,z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Pb1   0.00000   0.00000   0.00000
Ti1   0.50000   0.50000   0.50000
O1   0.50000   0.50000   0.00000
O2   0.50000   0.00000   0.50000
O3   0.00000   0.50000   0.50000