# generated using pymatgen data_Sc4CuSb4Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.44868274 _cell_length_b 4.44868354 _cell_length_c 14.79935329 _cell_angle_alpha 89.99999942 _cell_angle_beta 81.35569368 _cell_angle_gamma 120.00000481 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4CuSb4Ir3 _chemical_formula_sum 'Sc4 Cu1 Sb4 Ir3' _cell_volume 249.80163699 _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 Sc Sc0 1 0.25191805 0.62595852 0.12212343 1.0 Sc Sc1 1 0.74830370 0.87415185 0.37754444 1.0 Sc Sc2 1 0.25002512 0.12501206 0.62496282 1.0 Sc Sc3 1 0.74972330 0.37486115 0.87541555 1.0 Cu Cu4 1 0.87664712 0.93832306 0.18502981 1.0 Sb Sb5 1 0.99932800 0.49966400 0.50100800 1.0 Sb Sb6 1 0.49798306 0.74899203 0.75302491 1.0 Sb Sb7 1 0.00089070 0.00044585 0.99866345 1.0 Sb Sb8 1 0.50100507 0.25050253 0.24849240 1.0 Ir Ir9 1 0.37662300 0.18831100 0.43506600 1.0 Ir Ir10 1 0.87564065 0.43782032 0.68653903 1.0 Ir Ir11 1 0.37191323 0.68595562 0.94213115 1.0