# generated using pymatgen
data_BPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.15134992
_cell_length_b   4.71785566
_cell_length_c   5.14027676
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPd2
_chemical_formula_sum   'B2 Pd4'
_cell_volume   76.42365101
_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  0.50000000  0.50000000  0.50000000  1.0
  B  B1  1  -0.00000000  0.00000000  -0.00000000  1.0
  Pd  Pd2  1  0.50000000  0.75476279  0.15577763  1.0
  Pd  Pd3  1  0.50000000  0.24523721  0.84422237  1.0
  Pd  Pd4  1  0.00000000  0.74523721  0.65577763  1.0
  Pd  Pd5  1  -0.00000000  0.25476279  0.34422237  1.0