# generated using pymatgen data_Pr5Si9P3Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.86709103 _cell_length_b 12.86709095 _cell_length_c 3.98294866 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999515 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr5Si9P3Ir19 _chemical_formula_sum 'Pr5 Si9 P3 Ir19' _cell_volume 571.07888793 _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 0.33333300 0.66666700 0.50000000 1.0 Pr Pr1 1 0.66666700 0.33333300 0.50000000 1.0 Pr Pr2 1 0.00000000 0.81339283 0.00000000 1.0 Pr Pr3 1 0.18660717 0.18660717 0.00000000 1.0 Pr Pr4 1 0.81339283 0.00000000 0.00000000 1.0 Si Si5 1 0.00000000 0.62980417 0.50000000 1.0 Si Si6 1 0.37019583 0.37019583 0.50000000 1.0 Si Si7 1 0.62980417 0.00000000 0.50000000 1.0 Si Si8 1 0.52072142 0.68739697 0.00000000 1.0 Si Si9 1 0.31260303 0.83332445 0.00000000 1.0 Si Si10 1 0.16667555 0.47927858 0.00000000 1.0 Si Si11 1 0.47927858 0.16667555 0.00000000 1.0 Si Si12 1 0.68739697 0.52072142 0.00000000 1.0 Si Si13 1 0.83332445 0.31260303 0.00000000 1.0 P P14 1 1.00000000 0.18145163 0.50000000 1.0 P P15 1 0.81854837 0.81854837 0.50000000 1.0 P P16 1 0.18145163 1.00000000 0.50000000 1.0 Ir Ir17 1 0.51340950 0.87444585 0.00000000 1.0 Ir Ir18 1 0.12555415 0.63896465 0.00000000 1.0 Ir Ir19 1 0.36103535 0.48659050 0.00000000 1.0 Ir Ir20 1 0.48659050 0.36103535 0.00000000 1.0 Ir Ir21 1 0.87444585 0.51340950 0.00000000 1.0 Ir Ir22 1 0.63896465 0.12555415 0.00000000 1.0 Ir Ir23 1 1.00000000 0.44662976 0.50000000 1.0 Ir Ir24 1 0.55337024 0.55337024 0.50000000 1.0 Ir Ir25 1 0.44662976 1.00000000 0.50000000 1.0 Ir Ir26 1 1.00000000 0.28091548 0.00000000 1.0 Ir Ir27 1 0.71908452 0.71908452 0.00000000 1.0 Ir Ir28 1 0.28091548 1.00000000 0.00000000 1.0 Ir Ir29 1 0.62508723 0.80476311 0.50000000 1.0 Ir Ir30 1 0.19523689 0.82032411 0.50000000 1.0 Ir Ir31 1 0.17967589 0.37491277 0.50000000 1.0 Ir Ir32 1 0.37491277 0.17967589 0.50000000 1.0 Ir Ir33 1 0.80476311 0.62508723 0.50000000 1.0 Ir Ir34 1 0.82032411 0.19523689 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0