data_[Er12Cd4Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Cd  1.6900  1.5500  1.0900
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.0023]
_cell_length_b [8.6823]
_cell_length_c [10.8547]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9045]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Er6Cd2Os]
_chemical_formula_sum '[Er12 Cd4 Os2]'
_cell_volume [495.2171]
_cell_formula_units_Z [2]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
[
  Er  Er0  4  0.1313  0.0304  0.2326  1
  Er  Er1  4  0.1567  0.6688  0.0558  1
  Er  Er2  4  0.4464  0.1878  0.0457  1
  Cd  Cd3  4  0.3492  0.1162  0.7470  1
  Os  Os4  2  0.5000  0.0000  0.5000  1
]