data_global
_amcsd_formula_title 'Fe6 Ge6 Lu'
loop_
_publ_author_name
'Schobinger-Papamantellos P'
'Buschow K'
'de Boer F'
'Ritter C'
'Isnard O'
'Fauth F'
_journal_name_full 'Journal of Alloys and Compounds'
_journal_volume 267 
_journal_year 1998
_journal_page_first 59
_journal_page_last 65
_publ_section_title
;
 The Fe ordering in R Fe6 Ge6 compounds with non-magnetic R (R = Y, Lu, Hf)
 studied by neutron diffraction and magnetic measurements
 _cod_database_code 1008887
;
_database_code_amcsd 0016754
_chemical_formula_sum 'Lu.5 Ge3 Fe3'
_cell_length_a 5.09843
_cell_length_b 5.09843
_cell_length_c 8.08066
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 181.907
_exptl_crystal_density_diffrn      8.633
_symmetry_space_group_name_H-M 'P 6/m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-x+y,z'
  'x,x-y,-z'
  '-x+y,-x,-z'
  'x-y,x,z'
  '-y,-x,z'
  'y,x,-z'
  'y,-x+y,-z'
  '-y,x-y,z'
  'x-y,-y,z'
  '-x+y,y,-z'
  'x,y,-z'
  '-x,-y,z'
  'x,x-y,z'
  '-x,-x+y,-z'
  'x-y,x,-z'
  '-x+y,-x,z'
  'y,x,z'
  '-y,-x,-z'
  '-y,x-y,-z'
  'y,-x+y,z'
  '-x+y,y,z'
  'x-y,-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Lu1   0.00000   0.00000   0.00000   0.72000
Lu2   0.00000   0.00000   0.50000   0.28000
Ge1   0.33333   0.66667   0.50000   1.00000
Ge2   0.33333   0.66667   0.00000   1.00000
Ge3   0.00000   0.00000   0.34620   0.72000
Ge4   0.00000   0.00000   0.84620   0.28000
Fe1   0.50000   0.00000   0.25060   1.00000