data_[Sm2Ho4Ag6S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  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 [C2/m]
_cell_length_a [15.5412]
_cell_length_b [4.0707]
_cell_length_c [9.5630]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8602]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmHo2(AgS2)3]
_chemical_formula_sum '[Sm2 Ho4 Ag6 S12]'
_cell_volume [581.9618]
_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
[
  Sm  Sm0  2  0.0000  0.5000  0.0000  1.0
  Ho  Ho1  4  0.1658  0.0000  0.3368  1.0
  Ag  Ag2  4  0.1736  0.0000  0.9407  1.0
  Ag  Ag3  2  0.0000  0.5000  0.5000  1.0
  S  S4  4  0.0108  0.0000  0.8022  1.0
  S  S5  4  0.1575  0.5000  0.5204  1.0
  S  S6  4  0.1856  0.5000  0.1463  1.0
]