# generated using pymatgen data_Ga6Fe5CuIr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.26011406 _cell_length_b 6.01449227 _cell_length_c 12.78917462 _cell_angle_alpha 89.99996832 _cell_angle_beta 90.00255697 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ga6Fe5CuIr12 _chemical_formula_sum 'Ga6 Fe5 Cu1 Ir12' _cell_volume 327.68964271 _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 Ga Ga0 1 0.00000000 0.49999900 0.00000000 1.0 Ga Ga1 1 0.49984725 1.00000000 0.16306931 1.0 Ga Ga2 1 0.99986393 0.49999900 0.33222907 1.0 Ga Ga3 1 0.50000100 0.00000000 0.50000000 1.0 Ga Ga4 1 0.00013607 0.49999900 0.66777093 1.0 Ga Ga5 1 0.50015275 0.00000000 0.83692969 1.0 Fe Fe6 1 0.49986225 0.49999900 0.16514233 1.0 Fe Fe7 1 0.99990350 1.00000000 0.33234910 1.0 Fe Fe8 1 0.50000100 0.49999900 0.50000000 1.0 Fe Fe9 1 0.00009650 0.00000000 0.66765190 1.0 Fe Fe10 1 0.50014075 0.49999900 0.83485767 1.0 Cu Cu11 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir12 1 0.50000100 0.25395715 1.00000000 1.0 Ir Ir13 1 0.50000100 0.74604285 0.00000000 1.0 Ir Ir14 1 0.99986236 0.25133269 0.16925429 1.0 Ir Ir15 1 0.99986236 0.74866731 0.16925429 1.0 Ir Ir16 1 0.49985365 0.24909911 0.33422074 1.0 Ir Ir17 1 0.49985365 0.75090089 0.33422074 1.0 Ir Ir18 1 0.00000000 0.25092313 0.50000000 1.0 Ir Ir19 1 0.00000000 0.74907587 0.50000000 1.0 Ir Ir20 1 0.50014635 0.24909811 0.66577926 1.0 Ir Ir21 1 0.50014635 0.75089989 0.66577926 1.0 Ir Ir22 1 0.00013764 0.25133269 0.83074571 1.0 Ir Ir23 1 0.00013764 0.74866731 0.83074571 1.0