# generated using pymatgen data_MgZr3Si6Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.94541227 _cell_length_b 6.94541152 _cell_length_c 6.94541168 _cell_angle_alpha 109.20712430 _cell_angle_beta 109.20712891 _cell_angle_gamma 109.20713441 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgZr3Si6Ir7 _chemical_formula_sum 'Mg1 Zr3 Si6 Ir7' _cell_volume 260.40360094 _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 Mg Mg0 1 0.50000000 0.50000000 0.50000000 1.0 Zr Zr1 1 0.00000000 0.00000000 0.50000000 1.0 Zr Zr2 1 0.00000000 0.50000000 0.00000000 1.0 Zr Zr3 1 0.50000000 0.00000000 0.00000000 1.0 Si Si4 1 0.00749318 0.32300206 0.32300206 1.0 Si Si5 1 0.99250682 0.67699794 0.67699794 1.0 Si Si6 1 0.32300206 0.00749318 0.32300206 1.0 Si Si7 1 0.67699794 0.99250682 0.67699794 1.0 Si Si8 1 0.32300206 0.32300206 0.00749318 1.0 Si Si9 1 0.67699794 0.67699794 0.99250682 1.0 Ir Ir10 1 0.50000000 0.75015783 0.24984217 1.0 Ir Ir11 1 0.50000000 0.24984217 0.75015783 1.0 Ir Ir12 1 0.24984217 0.50000000 0.75015783 1.0 Ir Ir13 1 0.75015783 0.50000000 0.24984217 1.0 Ir Ir14 1 0.75015783 0.24984217 0.50000000 1.0 Ir Ir15 1 0.24984217 0.75015783 0.50000000 1.0 Ir Ir16 1 0.00000000 0.00000000 0.00000000 1.0