data_[Ho4Zr4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Zr  1.3300  1.5500  0.8600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.2428]
_cell_length_b [4.1428]
_cell_length_c [14.7359]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [HoZrTe3]
_chemical_formula_sum '[Ho4 Zr4 Te12]'
_cell_volume [625.2999]
_cell_formula_units_Z [4]
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  4  0.0252  0.2500  0.6257  1
  Zr  Zr1  4  0.1452  0.2500  0.0322  1
  Te  Te2  4  0.0043  0.7500  0.1327  1
  Te  Te3  4  0.1768  0.2500  0.4470  1
  Te  Te4  4  0.1979  0.7500  0.7010  1
]