data_[Rb6Ho2Er4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ho  1.2300  1.7500  1.0410
  Er  1.2400  1.7500  1.0300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0246]
_cell_length_b [12.1668]
_cell_length_c [8.0387]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.9301]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3Ho(ErS3)2]
_chemical_formula_sum '[Rb6 Ho2 Er4 S12]'
_cell_volume [657.2650]
_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
[
  Rb  Rb0  4  0.0000  0.1666  0.5000  1.0
  Rb  Rb1  2  0.0000  0.5000  0.5000  1.0
  Ho  Ho2  2  0.0000  0.0000  0.0000  1.0
  Er  Er3  4  0.0000  0.3333  0.0000  1.0
  S  S4  8  0.2307  0.1672  0.1905  1.0
  S  S5  4  0.2291  0.5000  0.1905  1.0
]