data_[Nd4Tm4Cd4]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.5266]
_cell_length_b [3.4711]
_cell_length_c [28.7011]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [NdTmCd]
_chemical_formula_sum '[Nd4 Tm4 Cd4]'
_cell_volume [351.3406]
_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
[
  Nd  Nd0  2  0.5000  0.0000  0.2775  1
  Nd  Nd1  2  0.5000  0.0000  0.4343  1
  Tm  Tm2  2  0.0000  0.0000  0.1697  1
  Tm  Tm3  2  0.5000  0.0000  0.5863  1
  Cd  Cd4  2  0.0000  0.0000  0.0146  1
  Cd  Cd5  2  0.0000  0.0000  0.8553  1
]