data_[Ho2Tm4In6S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.8410]
_cell_length_b [11.8491]
_cell_length_c [7.8551]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.8837]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HoTm2(InS2)3]
_chemical_formula_sum '[Ho2 Tm4 In6 S12]'
_cell_volume [609.2887]
_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  0.0000  0.0000  0.0000  1
  Tm  Tm1  4  0.0000  0.3334  0.0000  1
  In  In2  4  0.0000  0.1665  0.5000  1
  In  In3  2  0.0000  0.5000  0.5000  1
  S  S4  8  0.2342  0.1679  0.1991  1
  S  S5  4  0.2306  0.5000  0.1986  1
]