data_[Ho1Sc1In2Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.4648]
_cell_length_b [4.3281]
_cell_length_c [8.4205]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2203]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [HoSc(InTe2)2]
_chemical_formula_sum '[Ho1 Sc1 In2 Te4]'
_cell_volume [259.8573]
_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
[
  Ho  Ho0  1  0.5000  0.5000  0.0000  1.0
  Sc  Sc1  1  0.0000  0.0000  0.0000  1.0
  In  In2  1  0.0000  0.5000  0.5000  1.0
  In  In3  1  0.5000  0.0000  0.5000  1.0
  Te  Te4  2  0.2274  0.5000  0.2103  1.0
  Te  Te5  2  0.2521  0.0000  0.7844  1.0
]