data_[Nd4Tm4Pt12]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.9077]
_cell_length_b [27.0224]
_cell_length_c [4.2248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [NdTmPt3]
_chemical_formula_sum '[Nd4 Tm4 Pt12]'
_cell_volume [446.1271]
_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  4  0.0000  0.0747  0.2500  1.0
  Tm  Tm1  4  0.0000  0.2075  0.7500  1.0
  Pt  Pt2  4  0.0000  0.3114  0.7500  1.0
  Pt  Pt3  4  0.0000  0.3740  0.2500  1.0
  Pt  Pt4  4  0.0000  0.4706  0.2500  1.0
]