data_[Ba2Li4P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.5427]
_cell_length_b [4.3331]
_cell_length_c [10.7566]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.6701]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ba(LiP)2]
_chemical_formula_sum '[Ba2 Li4 P4]'
_cell_volume [210.6919]
_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  2  0.3033  0.7500  0.7296  1.0
  Li  Li1  2  0.1448  0.7500  0.1167  1.0
  Li  Li2  2  0.2492  0.2500  0.4977  1.0
  P  P3  2  0.2198  0.7500  0.3654  1.0
  P  P4  2  0.3939  0.2500  0.9858  1.0
]