data_[Cs4Cu2As4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cu  1.9000  1.3500  0.8200
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.0157]
_cell_length_b [5.6883]
_cell_length_c [5.5913]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.0077]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs2CuAs2]
_chemical_formula_sum '[Cs4 Cu2 As4]'
_cell_volume [413.7069]
_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
[
  Cs  Cs0  4  0.1411  0.5000  0.7383  1.0
  Cu  Cu1  2  0.0000  0.0000  0.5000  1.0
  As  As2  4  0.0753  0.0000  0.1351  1.0
]