data_[Ba4La2Be4As8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  La  1.1000  1.9500  1.1720
  Be  1.5700  1.0500  0.5900
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7924]
_cell_length_b [4.3241]
_cell_length_c [7.2471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.7547]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2La(BeAs2)2]
_chemical_formula_sum '[Ba4 La2 Be4 As8]'
_cell_volume [459.6444]
_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
[
  Ba  Ba0  4  0.1445  0.0000  0.5881  1.0
  La  La1  2  0.0000  0.0000  0.0000  1.0
  Be  Be2  4  0.1654  0.5000  0.9581  1.0
  As  As3  4  0.0156  0.5000  0.7195  1.0
  As  As4  4  0.2042  0.0000  0.1340  1.0
]