data_[Nd4Tm1Ag5]
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
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.7443]
_cell_length_b [3.7443]
_cell_length_c [18.4348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Nd4TmAg5]
_chemical_formula_sum '[Nd4 Tm1 Ag5]'
_cell_volume [258.4463]
_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  2  0.0000  0.0000  0.1947  1.0
  Nd  Nd1  2  0.0000  0.0000  0.3980  1.0
  Tm  Tm2  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag3  2  0.5000  0.5000  0.0879  1.0
  Ag  Ag4  2  0.5000  0.5000  0.2967  1.0
  Ag  Ag5  1  0.5000  0.5000  0.5000  1.0
]