data_[K6Nd2Ho4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8413]
_cell_length_b [13.5830]
_cell_length_c [8.6546]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6032]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K3Nd(HoTe3)2]
_chemical_formula_sum '[K6 Nd2 Ho4 Te12]'
_cell_volume [878.6190]
_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
[
  K  K0  4  0.0000  0.1645  0.5000  1
  K  K1  2  0.0000  0.5000  0.5000  1
  Nd  Nd2  2  0.0000  0.0000  0.0000  1
  Ho  Ho3  4  0.0000  0.3330  0.0000  1
  Te  Te4  8  0.2410  0.1708  0.2101  1
  Te  Te5  4  0.2280  0.5000  0.2094  1
]