# generated using pymatgen data_Mg4Tc(PIr)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.83505859 _cell_length_b 6.83505739 _cell_length_c 6.83505837 _cell_angle_alpha 109.47122645 _cell_angle_beta 109.47122292 _cell_angle_gamma 109.47122188 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg4Tc(PIr)6 _chemical_formula_sum 'Mg4 Tc1 P6 Ir6' _cell_volume 245.81291354 _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 Mg Mg1 1 0.00000000 0.00000000 0.50000000 1.0 Mg Mg2 1 0.50000000 0.00000000 0.00000000 1.0 Mg Mg3 1 0.00000000 0.50000000 0.00000000 1.0 Tc Tc4 1 0.00000000 0.00000000 0.00000000 1.0 P P5 1 0.31556938 0.00000000 0.31556938 1.0 P P6 1 0.68443062 1.00000000 0.68443062 1.0 P P7 1 1.00000000 0.68443062 0.68443062 1.0 P P8 1 0.00000000 0.31556938 0.31556938 1.0 P P9 1 0.68443062 0.68443062 1.00000000 1.0 P P10 1 0.31556938 0.31556938 0.00000000 1.0 Ir Ir11 1 0.25000000 0.75000000 0.50000000 1.0 Ir Ir12 1 0.25000000 0.50000000 0.75000000 1.0 Ir Ir13 1 0.50000000 0.75000000 0.25000000 1.0 Ir Ir14 1 0.50000000 0.25000000 0.75000000 1.0 Ir Ir15 1 0.75000000 0.25000000 0.50000000 1.0 Ir Ir16 1 0.75000000 0.50000000 0.25000000 1.0