data_[La12Bi2Sb6As4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.8503]
_cell_length_b [4.5500]
_cell_length_c [9.1306]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2946]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6BiSb3As2]
_chemical_formula_sum '[La12 Bi2 Sb6 As4]'
_cell_volume [802.5694]
_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  0.0055  0.0000  0.2570  1
  La  La1  4  0.1699  0.5000  0.0956  1
  La  La2  4  0.1706  0.5000  0.5751  1
  Bi  Bi3  2  0.0000  0.5000  0.0000  1
  Sb  Sb4  4  0.1642  0.0000  0.8315  1
  Sb  Sb5  2  0.0000  0.5000  0.5000  1
  As  As6  4  0.1683  0.0000  0.3354  1
]