# generated using pymatgen
data_Li2BPd6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64590553
_cell_length_b   5.64590552
_cell_length_c   5.64590705
_cell_angle_alpha   60.00000240
_cell_angle_beta   60.00000248
_cell_angle_gamma   60.00000158
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2BPd6
_chemical_formula_sum   'Li2 B1 Pd6'
_cell_volume   127.25825407
_cell_formula_units_Z   1
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
  Li  Li0  1  0.25000100  0.25000100  0.25000100  1.0
  Li  Li1  1  0.75000000  0.75000000  0.75000000  1.0
  B  B2  1  0.50000000  0.50000000  0.50000000  1.0
  Pd  Pd3  1  0.24294456  0.75705544  0.24294456  1.0
  Pd  Pd4  1  0.75705544  0.24294456  0.24294456  1.0
  Pd  Pd5  1  0.75705544  0.75705544  0.24294456  1.0
  Pd  Pd6  1  0.24294456  0.24294456  0.75705544  1.0
  Pd  Pd7  1  0.75705544  0.24294456  0.75705544  1.0
  Pd  Pd8  1  0.24294456  0.75705544  0.75705544  1.0