data_[La8Ho4Ag4S20]
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
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.0462]
_cell_length_b [16.8170]
_cell_length_c [12.1909]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La2HoAgS5]
_chemical_formula_sum '[La8 Ho4 Ag4 S20]'
_cell_volume [829.5283]
_cell_formula_units_Z [4]
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  4  0.0000  0.1106  0.6842  1.0
  La  La1  4  0.0000  0.1261  0.3050  1.0
  Ho  Ho2  4  0.0000  0.1956  0.0062  1.0
  Ag  Ag3  4  0.0000  0.4621  0.4650  1.0
  S  S4  4  0.0000  0.0480  0.0795  1.0
  S  S5  4  0.0000  0.2878  0.6613  1.0
  S  S6  4  0.0000  0.3061  0.3504  1.0
  S  S7  4  0.0000  0.3572  0.0003  1.0
  S  S8  4  0.0000  0.4979  0.7720  1.0
]