data_[Nd6Ho8In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [11.3019]
_cell_length_b [7.1085]
_cell_length_c [6.2221]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Nd3Ho4In]
_chemical_formula_sum '[Nd6 Ho8 In2]'
_cell_volume [499.8783]
_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  4  0.2383  0.6164  0.9730  1.0
  Nd  Nd1  2  0.0000  0.6276  0.6261  1.0
  Ho  Ho2  4  0.2392  0.1229  0.9888  1.0
  Ho  Ho3  2  0.0000  0.1276  0.6467  1.0
  Ho  Ho4  2  0.0000  0.8800  0.1661  1.0
  In  In5  2  0.0000  0.3599  0.1527  1.0
]