data_[K4Sm4Co4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sm  1.1700  1.8500  1.2290
  Co  1.8800  1.3500  0.7683
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [11.6997]
_cell_length_b [4.3192]
_cell_length_c [15.7081]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [KSmCoTe3]
_chemical_formula_sum '[K4 Sm4 Co4 Te12]'
_cell_volume [793.7834]
_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  0.2201  0.7500  0.5057  1
  Sm  Sm1  4  0.0178  0.2500  0.7592  1
  Co  Co2  4  0.2372  0.2500  0.2831  1
  Te  Te3  4  0.0542  0.2500  0.3745  1
  Te  Te4  4  0.0933  0.7500  0.8893  1
  Te  Te5  4  0.2371  0.7500  0.1846  1
]