# generated using pymatgen data_Sc6Sn6Ir11Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.29098646 _cell_length_b 7.21652024 _cell_length_c 12.87478950 _cell_angle_alpha 90.00007096 _cell_angle_beta 89.99996907 _cell_angle_gamma 89.99980998 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc6Sn6Ir11Rh _chemical_formula_sum 'Sc6 Sn6 Ir11 Rh1' _cell_volume 398.68061134 _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 0.00000019 0.49975260 0.99994605 1.0 Sc Sc1 1 0.50000518 0.00007956 0.16658989 1.0 Sc Sc2 1 0.00000427 0.49989784 0.33333950 1.0 Sc Sc3 1 0.49999976 0.00008545 0.50005973 1.0 Sc Sc4 1 0.99999447 0.49975342 0.66671813 1.0 Sc Sc5 1 0.49999602 0.00041262 0.83334769 1.0 Sn Sn6 1 0.00000005 0.99902398 0.99963739 1.0 Sn Sn7 1 0.50000353 0.49967894 0.16667165 1.0 Sn Sn8 1 0.00000897 0.00016050 0.33331740 1.0 Sn Sn9 1 0.49999798 0.49968684 0.49999216 1.0 Sn Sn10 1 0.99999533 0.99902113 0.66704913 1.0 Sn Sn11 1 0.49999728 0.50236114 0.83333450 1.0 Ir Ir12 1 0.49999896 0.24998107 0.99992773 1.0 Ir Ir13 1 0.50000137 0.74996610 0.00041692 1.0 Ir Ir14 1 0.00000293 0.24972482 0.16628886 1.0 Ir Ir15 1 0.00000370 0.74979869 0.16704730 1.0 Ir Ir16 1 0.50000487 0.24997463 0.33332707 1.0 Ir Ir17 1 0.50000357 0.75007286 0.33333755 1.0 Ir Ir18 1 0.99999865 0.24970822 0.50033426 1.0 Ir Ir19 1 0.99999713 0.74981956 0.49963457 1.0 Ir Ir20 1 0.49999712 0.24994436 0.66673518 1.0 Ir Ir21 1 0.49999396 0.75000944 0.66623938 1.0 Ir Ir22 1 0.99999727 0.25048207 0.83335055 1.0 Rh Rh23 1 0.99999745 0.75060016 0.83335541 1.0