data_[La12Sb2Te6P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.7331]
_cell_length_b [4.4403]
_cell_length_c [9.0813]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.8077]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6SbTe3P2]
_chemical_formula_sum '[La12 Sb2 Te6 P4]'
_cell_volume [769.2807]
_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
[
  La  La0  4  0.0127  0.0000  0.2532  1.0
  La  La1  4  0.1686  0.5000  0.1125  1.0
  La  La2  4  0.1756  0.5000  0.5657  1.0
  Sb  Sb3  2  0.0000  0.5000  0.0000  1.0
  Te  Te4  4  0.1624  0.0000  0.8325  1.0
  Te  Te5  2  0.0000  0.5000  0.5000  1.0
  P  P6  4  0.1689  0.0000  0.3358  1.0
]