data_[Ho12Ge4Te6As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ge  2.0100  1.2500  0.7700
  Te  2.1000  1.4000  1.2933
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5667]
_cell_length_b [4.2164]
_cell_length_c [8.5744]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4637]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho6Ge2Te3As]
_chemical_formula_sum '[Ho12 Ge4 Te6 As2]'
_cell_volume [649.9682]
_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
[
  Ho  Ho0  4  0.0084  0.0000  0.2355  1.0
  Ho  Ho1  4  0.1613  0.5000  0.1025  1.0
  Ho  Ho2  4  0.1735  0.5000  0.5655  1.0
  Ge  Ge3  4  0.1664  0.0000  0.3321  1.0
  Te  Te4  4  0.1653  0.0000  0.8336  1.0
  Te  Te5  2  0.0000  0.5000  0.5000  1.0
  As  As6  2  0.0000  0.5000  0.0000  1.0
]