# generated using pymatgen data_Er5Zr3(P3Pd4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.07890938 _cell_length_b 13.07890819 _cell_length_c 3.95430124 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000051 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er5Zr3(P3Pd4)4 _chemical_formula_sum 'Er5 Zr3 P12 Pd16' _cell_volume 585.79195436 _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 Er Er0 1 0.18678022 0.18678022 0.50000000 1.0 Er Er1 1 0.81321978 0.00000000 0.50000000 1.0 Er Er2 1 1.00000000 0.81321978 0.50000000 1.0 Er Er3 1 0.33333300 0.66666700 0.00000000 1.0 Er Er4 1 0.66666700 0.33333300 0.00000000 1.0 Zr Zr5 1 0.55277357 0.55277357 0.00000000 1.0 Zr Zr6 1 0.44722643 1.00000000 0.00000000 1.0 Zr Zr7 1 0.00000000 0.44722643 0.00000000 1.0 P P8 1 0.82741339 0.82741339 0.00000000 1.0 P P9 1 0.17258661 0.00000000 0.00000000 1.0 P P10 1 1.00000000 0.17258661 0.00000000 1.0 P P11 1 0.16498529 0.48119612 0.50000000 1.0 P P12 1 0.51880388 0.68378917 0.50000000 1.0 P P13 1 0.31621083 0.83501471 0.50000000 1.0 P P14 1 0.68378917 0.51880388 0.50000000 1.0 P P15 1 0.83501471 0.31621083 0.50000000 1.0 P P16 1 0.48119612 0.16498529 0.50000000 1.0 P P17 1 0.35490705 0.35490705 0.00000000 1.0 P P18 1 0.64509295 1.00000000 0.00000000 1.0 P P19 1 0.00000000 0.64509295 0.00000000 1.0 Pd Pd20 1 0.72726748 0.72726748 0.50000000 1.0 Pd Pd21 1 0.27273252 0.00000000 0.50000000 1.0 Pd Pd22 1 1.00000000 0.27273252 0.50000000 1.0 Pd Pd23 1 0.18279518 0.37259971 0.00000000 1.0 Pd Pd24 1 0.62740029 0.81019647 0.00000000 1.0 Pd Pd25 1 0.18980353 0.81720482 0.00000000 1.0 Pd Pd26 1 0.81019647 0.62740029 0.00000000 1.0 Pd Pd27 1 0.81720482 0.18980353 0.00000000 1.0 Pd Pd28 1 0.37259971 0.18279518 0.00000000 1.0 Pd Pd29 1 0.35658927 0.49204498 0.50000000 1.0 Pd Pd30 1 0.50795502 0.86454330 0.50000000 1.0 Pd Pd31 1 0.13545670 0.64341073 0.50000000 1.0 Pd Pd32 1 0.86454330 0.50795502 0.50000000 1.0 Pd Pd33 1 0.64341073 0.13545670 0.50000000 1.0 Pd Pd34 1 0.49204498 0.35658927 0.50000000 1.0 Pd Pd35 1 0.00000000 0.00000000 0.00000000 1.0