data_[Nd14Tm4Th4]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6423]
_cell_length_b [11.5322]
_cell_length_c [6.0739]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.5148]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd7(TmTh)2]
_chemical_formula_sum '[Nd14 Tm4 Th4]'
_cell_volume [753.3303]
_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
[
  Nd  Nd0  8  0.1855  0.2238  0.1794  1
  Nd  Nd1  4  0.0665  0.5000  0.7964  1
  Nd  Nd2  2  0.0000  0.0000  0.0000  1
  Tm  Tm3  4  0.2243  0.0000  0.6033  1
  Th  Th4  4  0.0000  0.2129  0.5000  1
]