# generated using pymatgen
data_Ba2P3Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.20842495
_cell_length_b   6.53864683
_cell_length_c   12.98182939
_cell_angle_alpha   88.28058662
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2P3Pd
_chemical_formula_sum   'Ba8 P12 Pd4'
_cell_volume   611.60154598
_cell_formula_units_Z   4
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  1  0.25561821  0.62046301  0.33675498  1.0
  Ba  Ba1  1  0.24438179  0.62046301  0.83675498  1.0
  Ba  Ba2  1  0.74438179  0.37953699  0.66324502  1.0
  Ba  Ba3  1  0.75561821  0.37953699  0.16324502  1.0
  Ba  Ba4  1  0.74860562  0.83314394  0.43954493  1.0
  Ba  Ba5  1  0.24860562  0.16685606  0.06045507  1.0
  Ba  Ba6  1  0.25139438  0.16685606  0.56045507  1.0
  Ba  Ba7  1  0.75139438  0.83314394  0.93954493  1.0
  P  P8  1  0.09041582  0.68883638  0.59668033  1.0
  P  P9  1  0.59041582  0.31116362  0.90331967  1.0
  P  P10  1  0.90958418  0.31116362  0.40331967  1.0
  P  P11  1  0.40958418  0.68883638  0.09668033  1.0
  P  P12  1  0.39024255  0.68556373  0.59662537  1.0
  P  P13  1  0.89024255  0.31443627  0.90337463  1.0
  P  P14  1  0.60975745  0.31443627  0.40337463  1.0
  P  P15  1  0.57291177  0.90407558  0.19261866  1.0
  P  P16  1  0.92708823  0.90407558  0.69261866  1.0
  P  P17  1  0.42708823  0.09592442  0.80738134  1.0
  P  P18  1  0.07291177  0.09592442  0.30738134  1.0
  P  P19  1  0.10975745  0.68556373  0.09662537  1.0
  Pd  Pd20  1  0.90057474  0.88516787  0.19331206  1.0
  Pd  Pd21  1  0.09942526  0.11483213  0.80668794  1.0
  Pd  Pd22  1  0.40057474  0.11483213  0.30668794  1.0
  Pd  Pd23  1  0.59942526  0.88516787  0.69331206  1.0