# generated using pymatgen data_ZrTiPd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.36951210 _cell_length_b 5.48048527 _cell_length_c 8.69888400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.66137672 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTiPd _chemical_formula_sum 'Zr4 Ti4 Pd4' _cell_volume 220.19878457 _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 Zr Zr0 1 0.64961900 0.32479700 0.56346000 1.0 Zr Zr1 1 0.32164400 0.66082200 0.44051600 1.0 Zr Zr2 1 0.32164400 0.66082200 0.05948400 1.0 Zr Zr3 1 0.64961900 0.32479700 0.93654000 1.0 Ti Ti4 1 0.69376400 0.84687300 0.75000000 1.0 Ti Ti5 1 0.82099600 0.65241000 0.25000000 1.0 Ti Ti6 1 0.82095100 0.16855700 0.25000000 1.0 Ti Ti7 1 0.34596900 0.17297600 0.25000000 1.0 Pd Pd8 1 0.98890400 0.99448900 0.49585000 1.0 Pd Pd9 1 0.98890400 0.99448900 0.00415000 1.0 Pd Pd10 1 0.19897200 0.35628000 0.75000000 1.0 Pd Pd11 1 0.19901500 0.84268800 0.75000000 1.0