data_[Nd1Tm1Th2Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Tm  1.2500  1.7500  1.0950
  Th  1.3000  1.8000  1.0800
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.8716]
_cell_length_b [4.5700]
_cell_length_c [7.9147]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [NdTm(ThBi2)2]
_chemical_formula_sum '[Nd1 Tm1 Th2 Bi4]'
_cell_volume [268.1341]
_cell_formula_units_Z [1]
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
[
  Nd  Nd0  1  0.0000  0.0000  0.0000  1
  Tm  Tm1  1  0.0000  0.5000  0.5000  1
  Th  Th2  1  0.5000  0.0000  0.5000  1
  Th  Th3  1  0.5000  0.5000  0.0000  1
  Bi  Bi4  2  0.2415  0.0000  0.7419  1
  Bi  Bi5  2  0.2457  0.5000  0.2537  1
]