data_[Ho2Bi2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Bi  2.0200  1.6000  1.0350
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.0887]
_cell_length_b [4.0033]
_cell_length_c [9.9769]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1411]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [HoBiS3]
_chemical_formula_sum '[Ho2 Bi2 S6]'
_cell_volume [283.1260]
_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
[
  Ho  Ho0  2  0.0744  0.7500  0.1763  1
  Bi  Bi1  2  0.4168  0.7500  0.8133  1
  S  S2  2  0.0889  0.7500  0.6869  1
  S  S3  2  0.2220  0.2500  0.0075  1
  S  S4  2  0.4091  0.7500  0.3167  1
]