[CIF]
data_BaBP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05386450
_cell_length_b   4.05386450
_cell_length_c   9.16155103
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBP
_chemical_formula_sum   'Ba2 B2 P2'
_cell_volume   150.55925658
_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
  B  B0  1  2.02693225  0.00000000  0.56333754  1
  B  B1  1  0.00000000  2.02693225  8.59821349  1
  Ba  Ba2  1  2.02693225  0.00000000  6.69362854  1
  Ba  Ba3  1  0.00000000  2.02693225  2.46792249  1
  P  P4  1  0.00000000  0.00000000  0.00000000  1
  P  P5  1  2.02693225  2.02693225  0.00000000  1
[/CIF]
