data_[Li2As2W4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  As  2.1800  1.1500  0.6600
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.7196]
_cell_length_b [2.9500]
_cell_length_c [4.7698]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2568]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiAsW2]
_chemical_formula_sum '[Li2 As2 W4]'
_cell_volume [120.7344]
_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
[
  Li  Li0  2  0.2582  0.5000  0.2583  1
  As  As1  2  0.0015  0.5000  0.4910  1
  W  W2  2  0.0023  0.0000  0.0080  1
  W  W3  2  0.2380  0.0000  0.7427  1
]