data_[Sm6Ho8In2]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [11.2605]
_cell_length_b [7.0745]
_cell_length_c [6.1992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Sm3Ho4In]
_chemical_formula_sum '[Sm6 Ho8 In2]'
_cell_volume [493.8421]
_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  4  0.2394  0.6160  0.9728  1.0
  Sm  Sm1  2  0.0000  0.6280  0.6285  1.0
  Ho  Ho2  4  0.2393  0.1241  0.9900  1.0
  Ho  Ho3  2  0.0000  0.1291  0.6442  1.0
  Ho  Ho4  2  0.0000  0.8773  0.1659  1.0
  In  In5  2  0.0000  0.3651  0.1511  1.0
]