# generated using pymatgen data_CrRe(TcIr2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43368899 _cell_length_b 5.48438265 _cell_length_c 4.33239128 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.69469711 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrRe(TcIr2)2 _chemical_formula_sum 'Cr1 Re1 Tc2 Ir4' _cell_volume 112.15243441 _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 Cr Cr0 1 0.66675419 0.33350737 0.25000000 1.0 Re Re1 1 0.33233434 0.66466969 0.75000000 1.0 Tc Tc2 1 0.16747864 0.33495429 0.25000000 1.0 Tc Tc3 1 0.83017528 0.66035157 0.75000000 1.0 Ir Ir4 1 0.66721434 0.83147367 0.25000000 1.0 Ir Ir5 1 0.16426133 0.83147367 0.25000000 1.0 Ir Ir6 1 0.33815851 0.17178388 0.75000000 1.0 Ir Ir7 1 0.83362436 0.17178388 0.75000000 1.0