# generated using pymatgen data_NaSiPIr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.65988515 _cell_length_b 5.65988505 _cell_length_c 5.65988531 _cell_angle_alpha 138.35061410 _cell_angle_beta 138.35061350 _cell_angle_gamma 60.36643615 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaSiPIr2 _chemical_formula_sum 'Na1 Si1 P1 Ir2' _cell_volume 79.23405969 _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 Na Na0 1 0.00046929 0.00046929 0.00000000 1.0 Si Si1 1 0.37890985 0.37890985 1.00000000 1.0 P P2 1 0.62439018 0.62439018 0.00000000 1.0 Ir Ir3 1 0.24811684 0.74811684 0.50000000 1.0 Ir Ir4 1 0.74811684 0.24811684 0.50000000 1.0