data_[La1Pr6Ho4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [11.2099]
_cell_length_b [11.2099]
_cell_length_c [3.6140]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [La(Pr3Ho2)2]
_chemical_formula_sum '[La1 Pr6 Ho4]'
_cell_volume [393.2988]
_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
[
  La  La0  1  0.0000  0.0000  0.0000  1
  Pr  Pr1  3  0.1831  0.3663  0.5000  1
  Pr  Pr2  3  0.5247  0.0493  0.0000  1
  Ho  Ho3  3  0.3242  0.1621  0.5000  1
  Ho  Ho4  1  0.3333  0.6667  0.0000  1
]