data_[Ce6Er2Tm4Bi12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Er  1.2400  1.7500  1.0300
  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 [7.8353]
_cell_length_b [13.5772]
_cell_length_c [7.8209]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5247]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3Er(TmBi3)2]
_chemical_formula_sum '[Ce6 Er2 Tm4 Bi12]'
_cell_volume [784.1533]
_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
[
  Ce  Ce0  4  0.0000  0.1664  0.5000  1.0
  Ce  Ce1  2  0.0000  0.5000  0.5000  1.0
  Er  Er2  2  0.0000  0.0000  0.0000  1.0
  Tm  Tm3  4  0.0000  0.3333  0.0000  1.0
  Bi  Bi4  8  0.2469  0.1670  0.2401  1.0
  Bi  Bi5  4  0.2461  0.5000  0.2398  1.0
]