data_[K4Tm4Ag4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Tm  1.2500  1.7500  1.0950
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [16.4943]
_cell_length_b [4.2793]
_cell_length_c [11.4668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [KTmAgTe3]
_chemical_formula_sum '[K4 Tm4 Ag4 Te12]'
_cell_volume [809.3749]
_cell_formula_units_Z [4]
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  0.2298  0.2500  0.4564  1
  Tm  Tm1  4  0.0195  0.2500  0.1608  1
  Ag  Ag2  4  0.0155  0.7500  0.4077  1
  Te  Te3  4  0.0958  0.7500  0.6302  1
  Te  Te4  4  0.1005  0.2500  0.9227  1
  Te  Te5  4  0.1384  0.7500  0.2375  1
]