# generated using pymatgen data_Ti12Cd(Sn2Sb)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.24564183 _cell_length_b 9.24689531 _cell_length_c 5.66487146 _cell_angle_alpha 90.01383187 _cell_angle_beta 89.99990883 _cell_angle_gamma 119.99596380 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12Cd(Sn2Sb)3 _chemical_formula_sum 'Ti12 Cd1 Sn6 Sb3' _cell_volume 419.44144682 _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 Ti Ti0 1 0.84015245 0.68033069 0.75798408 1.0 Ti Ti1 1 0.16227477 0.84692287 0.24211992 1.0 Ti Ti2 1 0.68464959 0.84691994 0.24211281 1.0 Ti Ti3 1 0.31066433 0.15885960 0.75798582 1.0 Ti Ti4 1 0.84817057 0.15883093 0.75798351 1.0 Ti Ti5 1 0.15315678 0.30631850 0.24162873 1.0 Ti Ti6 1 0.50168158 0.00332536 0.49840021 1.0 Ti Ti7 1 0.49860341 0.49845196 0.99956554 1.0 Ti Ti8 1 0.99983449 0.49843401 0.99956634 1.0 Ti Ti9 1 0.99994487 0.49928563 0.50075461 1.0 Ti Ti10 1 0.50161057 0.00318456 0.00135669 1.0 Ti Ti11 1 0.49934385 0.49930638 0.50075804 1.0 Cd Cd12 1 0.99497635 0.98996867 0.50032789 1.0 Sn Sn13 1 0.59925069 0.80158778 0.74524670 1.0 Sn Sn14 1 0.20234567 0.80158758 0.74524878 1.0 Sn Sn15 1 0.80171158 0.60342657 0.25513479 1.0 Sn Sn16 1 0.66701134 0.33402009 0.75464195 1.0 Sn Sn17 1 0.33380984 0.66761883 0.24578496 1.0 Sn Sn18 1 0.99583514 0.99167642 0.99818846 1.0 Sb Sb19 1 0.20194432 0.40390590 0.74480515 1.0 Sb Sb20 1 0.80191529 0.20301341 0.25520495 1.0 Sb Sb21 1 0.40111251 0.20302633 0.25520409 1.0