# generated using pymatgen data_Lu5BPd15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.11993539 _cell_length_b 4.11993539 _cell_length_c 20.05359712 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu5BPd15 _chemical_formula_sum 'Lu5 B1 Pd15' _cell_volume 340.38710336 _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 Lu Lu0 1 0.00000000 0.00000000 0.98971889 1.0 Lu Lu1 1 0.00000000 0.00000000 0.21028111 1.0 Lu Lu2 1 0.00000000 0.00000000 0.40520846 1.0 Lu Lu3 1 0.00000000 0.00000000 0.60000000 1.0 Lu Lu4 1 0.00000000 0.00000000 0.79479154 1.0 B B5 1 0.50000000 0.50000000 0.10000000 1.0 Pd Pd6 1 0.00000000 0.50000000 0.10000000 1.0 Pd Pd7 1 0.00000000 0.50000000 0.30276522 1.0 Pd Pd8 1 0.00000000 0.50000000 0.50075801 1.0 Pd Pd9 1 0.00000000 0.50000000 0.69924199 1.0 Pd Pd10 1 0.00000000 0.50000000 0.89723478 1.0 Pd Pd11 1 0.50000000 0.50000000 0.99522785 1.0 Pd Pd12 1 0.50000000 0.50000000 0.20477215 1.0 Pd Pd13 1 0.50000000 0.50000000 0.40062106 1.0 Pd Pd14 1 0.50000000 0.50000000 0.60000000 1.0 Pd Pd15 1 0.50000000 0.50000000 0.79937894 1.0 Pd Pd16 1 0.50000000 0.00000000 0.10000000 1.0 Pd Pd17 1 0.50000000 0.00000000 0.30276522 1.0 Pd Pd18 1 0.50000000 0.00000000 0.50075801 1.0 Pd Pd19 1 0.50000000 0.00000000 0.69924199 1.0 Pd Pd20 1 0.50000000 0.00000000 0.89723478 1.0