data_[La1Ag2Bi1S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ag  1.9300  1.6000  1.0867
  Bi  2.0200  1.6000  1.0350
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.6712]
_cell_length_b [4.1562]
_cell_length_c [7.2055]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.3526]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [LaAg2BiS4]
_chemical_formula_sum '[La1 Ag2 Bi1 S4]'
_cell_volume [184.7734]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag1  1  0.5000  0.0000  0.5000  1.0
  Ag  Ag2  1  0.5000  0.5000  0.0000  1.0
  Bi  Bi3  1  0.0000  0.5000  0.5000  1.0
  S  S4  2  0.2521  0.5000  0.2599  1.0
  S  S5  2  0.2583  0.0000  0.7533  1.0
]