data_global
_amcsd_formula_title 'FeTiO3'
loop_
_publ_author_name
'Leinenweber K'
'Linton J'
'Navrotsky A'
'Fei Y'
'Parise J B'
_journal_name_full 'Physics and Chemistry of Minerals'
_journal_volume 22 
_journal_year 1995
_journal_page_first 251
_journal_page_last 258
_publ_section_title
;
 High-pressure perovskites on the join CaTiO3-FeTiO3
;
_database_code_amcsd 0007917
_chemical_formula_sum 'Fe Ti O3'
_cell_length_a 5.12334
_cell_length_b 5.12334
_cell_length_c 13.76020
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 312.796
_exptl_crystal_density_diffrn      4.833
_symmetry_space_group_name_H-M 'R 3 c'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '2/3+x,1/3+y,1/3+z'
  '1/3+x,2/3+y,2/3+z'
  'x,x-y,1/2+z'
  '2/3+x,1/3+x-y,5/6+z'
  '1/3+x,2/3+x-y,1/6+z'
  '-y,-x,1/2+z'
  '2/3-y,1/3-x,5/6+z'
  '1/3-y,2/3-x,1/6+z'
  '-x+y,y,1/2+z'
  '2/3-x+y,1/3+y,5/6+z'
  '1/3-x+y,2/3+y,1/6+z'
  '-y,x-y,z'
  '2/3-y,1/3+x-y,1/3+z'
  '1/3-y,2/3+x-y,2/3+z'
  '-x+y,-x,z'
  '2/3-x+y,1/3-x,1/3+z'
  '1/3-x+y,2/3-x,2/3+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Fe   0.00000   0.00000   0.28710
Ti   0.00000   0.00000   0.00000
O   0.04490   0.34460   0.06410