data_[La1Ho1P2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ho  1.2300  1.7500  1.0410
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.6024]
_cell_length_b [6.6024]
_cell_length_c [8.6194]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [LaHo(PS4)2]
_chemical_formula_sum '[La1 Ho1 P2 S8]'
_cell_volume [325.3999]
_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  0.5000  1
  Ho  Ho1  1  0.0000  0.0000  0.0000  1
  P  P2  2  0.3333  0.6667  0.6934  1
  S  S3  6  0.1636  0.3271  0.7743  1
  S  S4  2  0.3333  0.6667  0.4636  1
]