data_[Nd15Tm1In4]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.9901]
_cell_length_b [4.9901]
_cell_length_c [25.4063]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Nd15TmIn4]
_chemical_formula_sum '[Nd15 Tm1 In4]'
_cell_volume [632.6484]
_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  4  0.0000  0.5000  0.1043  1
  Nd  Nd1  4  0.0000  0.5000  0.3024  1
  Nd  Nd2  2  0.0000  0.5000  0.5000  1
  Nd  Nd3  2  0.5000  0.5000  0.2035  1
  Nd  Nd4  2  0.5000  0.5000  0.4012  1
  Nd  Nd5  1  0.5000  0.5000  0.0000  1
  Tm  Tm6  1  0.0000  0.0000  0.0000  1
  In  In7  2  0.0000  0.0000  0.2049  1
  In  In8  2  0.0000  0.0000  0.4014  1
]