data_[Ho4Ga1Hg1Te2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.1293]
_cell_length_b [4.1057]
_cell_length_c [7.9834]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1760]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ho4GaHgTe2]
_chemical_formula_sum '[Ho4 Ga1 Hg1 Te2]'
_cell_volume [223.2621]
_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  2  0.2540  0.5000  0.2437  1.0
  Ho  Ho1  2  0.2607  0.0000  0.7623  1.0
  Ga  Ga2  1  0.5000  0.5000  0.0000  1.0
  Hg  Hg3  1  0.0000  0.0000  0.0000  1.0
  Te  Te4  1  0.0000  0.5000  0.5000  1.0
  Te  Te5  1  0.5000  0.0000  0.5000  1.0
]