data_global
_amcsd_formula_title 'Al F5 Fe'
loop_
_publ_author_name
'Fourquet J'
'Calage Y'
'Bentrup U'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 108 
_journal_year 1994
_journal_page_first 189
_journal_page_last 192
_publ_section_title
;
 FeAlF5: Synthesis and crystal structure
 _cod_database_code 1000363
;
_database_code_amcsd 0013792
_chemical_formula_sum 'Fe Al F5'
_cell_length_a 7.4289
_cell_length_b 6.203
_cell_length_c 3.5574
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 163.930
_exptl_crystal_density_diffrn      3.602
_symmetry_space_group_name_H-M 'I m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  'x,-y,z'
  '1/2+x,1/2-y,1/2+z'
  '-x,y,-z'
  '1/2-x,1/2+y,1/2-z'
  '-x,y,z'
  '1/2-x,1/2+y,1/2+z'
  'x,-y,-z'
  '1/2+x,1/2-y,1/2-z'
  'x,y,-z'
  '1/2+x,1/2+y,1/2-z'
  '-x,-y,z'
  '1/2-x,1/2-y,1/2+z'
  '-x,-y,-z'
  '1/2-x,1/2-y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Fe1   0.00000   0.00000   0.00000
Al1   0.00000   0.50000   0.50000
F1   0.74200   0.00000   0.00000
F2   0.50000   0.00000   0.50000
F3   0.00000   0.20900   0.50000