# generated using pymatgen data_Ho5Sc3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.78408281 _cell_length_b 12.78408370 _cell_length_c 3.93889409 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000280 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho5Sc3(P3Ir4)4 _chemical_formula_sum 'Ho5 Sc3 P12 Ir16' _cell_volume 557.49901348 _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 Ho Ho0 1 0.33333300 0.66666700 0.50000000 1.0 Ho Ho1 1 0.66666700 0.33333300 0.50000000 1.0 Ho Ho2 1 1.00000000 0.81217176 0.00000000 1.0 Ho Ho3 1 0.18782824 0.18782824 0.00000000 1.0 Ho Ho4 1 0.81217176 1.00000000 0.00000000 1.0 Sc Sc5 1 1.00000000 0.44401856 0.50000000 1.0 Sc Sc6 1 0.55598144 0.55598144 0.50000000 1.0 Sc Sc7 1 0.44401856 1.00000000 0.50000000 1.0 P P8 1 0.00000000 0.64603973 0.50000000 1.0 P P9 1 0.35396027 0.35396027 0.50000000 1.0 P P10 1 0.64603973 0.00000000 0.50000000 1.0 P P11 1 0.51735500 0.68796323 0.00000000 1.0 P P12 1 0.31203677 0.82939177 0.00000000 1.0 P P13 1 0.17060823 0.48264500 0.00000000 1.0 P P14 1 0.48264500 0.17060823 0.00000000 1.0 P P15 1 0.68796323 0.51735500 0.00000000 1.0 P P16 1 0.82939177 0.31203677 0.00000000 1.0 P P17 1 0.00000000 0.17635738 0.50000000 1.0 P P18 1 0.82364262 0.82364262 0.50000000 1.0 P P19 1 0.17635738 0.00000000 0.50000000 1.0 Ir Ir20 1 0.50800146 0.86710975 0.00000000 1.0 Ir Ir21 1 0.13289025 0.64089271 0.00000000 1.0 Ir Ir22 1 0.35910729 0.49199854 0.00000000 1.0 Ir Ir23 1 0.49199854 0.35910729 0.00000000 1.0 Ir Ir24 1 0.86710975 0.50800146 0.00000000 1.0 Ir Ir25 1 0.64089271 0.13289025 0.00000000 1.0 Ir Ir26 1 1.00000000 0.27683133 0.00000000 1.0 Ir Ir27 1 0.72316867 0.72316867 0.00000000 1.0 Ir Ir28 1 0.27683133 1.00000000 0.00000000 1.0 Ir Ir29 1 0.62855289 0.80789728 0.50000000 1.0 Ir Ir30 1 0.19210272 0.82065561 0.50000000 1.0 Ir Ir31 1 0.17934439 0.37144711 0.50000000 1.0 Ir Ir32 1 0.37144711 0.17934439 0.50000000 1.0 Ir Ir33 1 0.80789728 0.62855289 0.50000000 1.0 Ir Ir34 1 0.82065561 0.19210272 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0