data_[La4Tm12Bi8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tm  1.2500  1.7500  1.0950
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5718]
_cell_length_b [4.7115]
_cell_length_c [11.4253]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.2506]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaTm3Bi2]
_chemical_formula_sum '[La4 Tm12 Bi8]'
_cell_volume [764.2684]
_cell_formula_units_Z [4]
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
[
  La  La0  4  0.1369  0.0000  0.0648  1.0
  Tm  Tm1  4  0.0432  0.0000  0.3581  1.0
  Tm  Tm2  4  0.1196  0.5000  0.6198  1.0
  Tm  Tm3  4  0.2171  0.5000  0.3879  1.0
  Bi  Bi4  4  0.0056  0.5000  0.1577  1.0
  Bi  Bi5  4  0.1977  0.0000  0.8205  1.0
]