data_[Y6Ho8Zr2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [11.6311]
_cell_length_b [13.0628]
_cell_length_c [3.3403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Y3Ho4Zr]
_chemical_formula_sum '[Y6 Ho8 Zr2]'
_cell_volume [507.5099]
_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
[
  Y  Y0  4  0.2500  0.2500  0.0000  1
  Y  Y1  2  0.0000  0.5000  0.5000  1
  Ho  Ho2  4  0.0000  0.2360  0.5000  1
  Ho  Ho3  4  0.2275  0.0000  0.0000  1
  Zr  Zr4  2  0.0000  0.0000  0.5000  1
]