data_[Ba4La2Al4P8]
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
  Al  1.6100  1.2500  0.6750
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.6399]
_cell_length_b [4.1804]
_cell_length_c [7.6279]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0788]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2La(AlP2)2]
_chemical_formula_sum '[Ba4 La2 Al4 P8]'
_cell_volume [468.4085]
_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  0.1288  0.0000  0.5523  1.0
  La  La1  2  0.0000  0.0000  0.0000  1.0
  Al  Al2  4  0.1748  0.5000  0.9814  1.0
  P  P3  4  0.0288  0.5000  0.7501  1.0
  P  P4  4  0.2098  0.0000  0.1707  1.0
]