data_[Ho8Er6Zr1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Er  1.2400  1.7500  1.0300
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [9.6732]
_cell_length_b [9.6732]
_cell_length_c [5.7223]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Ho8Er6Zr]
_chemical_formula_sum '[Ho8 Er6 Zr1]'
_cell_volume [463.7072]
_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  6  0.0515  0.7810  0.2340  1
  Ho  Ho1  2  0.3333  0.6667  0.2355  1
  Er  Er2  6  0.0930  0.6208  0.7459  1
  Zr  Zr3  1  0.0000  0.0000  0.5000  1
]