# generated using pymatgen data_Pr7Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.19604901 _cell_length_b 10.19604901 _cell_length_c 6.44724489 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000045 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr7Ir3 _chemical_formula_sum 'Pr14 Ir6' _cell_volume 580.45509149 _cell_formula_units_Z 2 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 0.47603111 1.0 Pr Pr1 1 0.66666700 0.33333300 0.97603111 1.0 Pr Pr2 1 0.12641139 0.87358861 0.24510653 1.0 Pr Pr3 1 0.74717822 0.87358861 0.24510653 1.0 Pr Pr4 1 0.12641139 0.25282178 0.24510653 1.0 Pr Pr5 1 0.87358861 0.12641139 0.74510653 1.0 Pr Pr6 1 0.25282178 0.12641139 0.74510653 1.0 Pr Pr7 1 0.87358861 0.74717822 0.74510653 1.0 Pr Pr8 1 0.53894405 0.46105595 0.43686338 1.0 Pr Pr9 1 0.92211190 0.46105595 0.43686338 1.0 Pr Pr10 1 0.53894405 0.07788810 0.43686338 1.0 Pr Pr11 1 0.46105595 0.53894405 0.93686338 1.0 Pr Pr12 1 0.07788810 0.53894405 0.93686338 1.0 Pr Pr13 1 0.46105595 0.92211190 0.93686338 1.0 Ir Ir14 1 0.81255286 0.18744714 0.19303505 1.0 Ir Ir15 1 0.37489429 0.18744714 0.19303505 1.0 Ir Ir16 1 0.81255286 0.62510571 0.19303505 1.0 Ir Ir17 1 0.18744714 0.81255286 0.69303505 1.0 Ir Ir18 1 0.62510571 0.81255286 0.69303505 1.0 Ir Ir19 1 0.18744714 0.37489429 0.69303505 1.0