# generated using pymatgen data_Pr4ErSi12Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.85063365 _cell_length_b 12.85063375 _cell_length_c 4.00998748 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000479 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr4ErSi12Ir19 _chemical_formula_sum 'Pr4 Er1 Si12 Ir19' _cell_volume 573.48586328 _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 Pr Pr0 1 0.66666700 0.33333300 0.00000000 1.0 Pr Pr1 1 0.81503883 0.81425577 0.50000000 1.0 Pr Pr2 1 0.18574423 0.00078306 0.50000000 1.0 Pr Pr3 1 0.99921694 0.18496117 0.50000000 1.0 Er Er4 1 0.33333300 0.66666700 0.00000000 1.0 Si Si5 1 0.68839589 0.16657969 0.50000000 1.0 Si Si6 1 0.83342031 0.52181520 0.50000000 1.0 Si Si7 1 0.47818480 0.31160411 0.50000000 1.0 Si Si8 1 0.17225609 0.69004405 0.50000000 1.0 Si Si9 1 0.51778696 0.82774391 0.50000000 1.0 Si Si10 1 0.30995595 0.48221304 0.50000000 1.0 Si Si11 1 0.62882689 0.62853151 0.00000000 1.0 Si Si12 1 0.37146849 0.00029438 0.00000000 1.0 Si Si13 1 0.99970562 0.37117311 0.00000000 1.0 Si Si14 1 0.18413106 0.18599613 0.00000000 1.0 Si Si15 1 0.81400387 0.99813493 0.00000000 1.0 Si Si16 1 0.00186507 0.81586894 0.00000000 1.0 Ir Ir17 1 0.80358750 0.18172154 0.00000000 1.0 Ir Ir18 1 0.81827846 0.62186596 0.00000000 1.0 Ir Ir19 1 0.37813404 0.19641250 0.00000000 1.0 Ir Ir20 1 0.18506481 0.80294776 0.00000000 1.0 Ir Ir21 1 0.61788295 0.81493519 0.00000000 1.0 Ir Ir22 1 0.19705224 0.38211705 0.00000000 1.0 Ir Ir23 1 0.44697385 0.44650913 0.00000000 1.0 Ir Ir24 1 0.55349087 0.00046472 0.00000000 1.0 Ir Ir25 1 0.99953528 0.55302615 0.00000000 1.0 Ir Ir26 1 0.28469825 0.28700964 0.50000000 1.0 Ir Ir27 1 0.71299036 0.99768862 0.50000000 1.0 Ir Ir28 1 0.00231138 0.71530175 0.50000000 1.0 Ir Ir29 1 0.87522402 0.36189858 0.50000000 1.0 Ir Ir30 1 0.63810142 0.51332745 0.50000000 1.0 Ir Ir31 1 0.48667255 0.12477598 0.50000000 1.0 Ir Ir32 1 0.36382486 0.87291690 0.50000000 1.0 Ir Ir33 1 0.50909304 0.63617514 0.50000000 1.0 Ir Ir34 1 0.12708310 0.49090696 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0