# generated using pymatgen data_BPd4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.36500780 _cell_length_b 2.89202997 _cell_length_c 5.85631500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.01727593 _symmetry_Int_Tables_number 1 _chemical_formula_structural BPd4 _chemical_formula_sum 'B1 Pd4' _cell_volume 73.92855570 _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 B B0 1 0.25000000 0.50000000 0.13677300 1.0 Pd Pd1 1 0.75000000 0.50000000 0.13243900 1.0 Pd Pd2 1 0.75000000 0.00000000 0.67083600 1.0 Pd Pd3 1 0.25000000 0.00000000 0.38053000 1.0 Pd Pd4 1 0.25000000 0.50000000 0.80242200 1.0