data_[La8Ho4Mn4S20]
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
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.9808]
_cell_length_b [16.6632]
_cell_length_c [12.1191]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La2HoMnS5]
_chemical_formula_sum '[La8 Ho4 Mn4 S20]'
_cell_volume [803.8853]
_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  0.1185  0.6916  1.0
  La  La1  4  0.0000  0.1241  0.3384  1.0
  Ho  Ho2  4  0.0000  0.1875  0.0227  1.0
  Mn  Mn3  4  0.0000  0.4486  0.4310  1.0
  S  S4  4  0.0000  0.0227  0.0253  1.0
  S  S5  4  0.0000  0.3006  0.6782  1.0
  S  S6  4  0.0000  0.3115  0.3638  1.0
  S  S7  4  0.0000  0.3490  0.0147  1.0
  S  S8  4  0.0000  0.4942  0.7582  1.0
]