data_[Nd2Ho4In6Se12]
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
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2548]
_cell_length_b [12.5604]
_cell_length_c [8.1113]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.3208]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdHo2(InSe2)3]
_chemical_formula_sum '[Nd2 Ho4 In6 Se12]'
_cell_volume [705.6163]
_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  2  0.0000  0.0000  0.0000  1.0
  Ho  Ho1  4  0.0000  0.3333  0.0000  1.0
  In  In2  4  0.0000  0.1647  0.5000  1.0
  In  In3  2  0.0000  0.5000  0.5000  1.0
  Se  Se4  8  0.2418  0.1715  0.2107  1.0
  Se  Se5  4  0.2263  0.5000  0.2080  1.0
]