# generated using pymatgen data_Tm8Sc12Si13Pt3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04882677 _cell_length_b 7.37585351 _cell_length_c 13.94773121 _cell_angle_alpha 89.60308774 _cell_angle_beta 89.74094621 _cell_angle_gamma 90.64503664 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Sc12Si13Pt3 _chemical_formula_sum 'Tm8 Sc12 Si13 Pt3' _cell_volume 725.08705638 _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 Tm Tm0 1 0.01037732 0.17792032 0.09615699 1.0 Tm Tm1 1 0.99048729 0.82333800 0.90451959 1.0 Tm Tm2 1 0.48685032 0.68117826 0.90566953 1.0 Tm Tm3 1 0.99112678 0.81745124 0.59506649 1.0 Tm Tm4 1 0.51216778 0.32212308 0.09465618 1.0 Tm Tm5 1 0.01057581 0.17965600 0.40498512 1.0 Tm Tm6 1 0.50739011 0.32094052 0.40418982 1.0 Tm Tm7 1 0.48340994 0.67180850 0.59646717 1.0 Sc Sc8 1 0.15914667 0.50247678 0.74855137 1.0 Sc Sc9 1 0.84104233 0.49839160 0.25091207 1.0 Sc Sc10 1 0.33131563 0.99989421 0.25028066 1.0 Sc Sc11 1 0.66786931 0.99811353 0.74910238 1.0 Sc Sc12 1 0.33030574 0.18392365 0.62209852 1.0 Sc Sc13 1 0.67460764 0.82499591 0.37432011 1.0 Sc Sc14 1 0.17056910 0.66751383 0.37778176 1.0 Sc Sc15 1 0.67825814 0.82677527 0.12486709 1.0 Sc Sc16 1 0.83074115 0.32918506 0.62491703 1.0 Sc Sc17 1 0.32299564 0.17340721 0.87497214 1.0 Sc Sc18 1 0.83383303 0.32114774 0.87543969 1.0 Sc Sc19 1 0.16886548 0.67735047 0.12468483 1.0 Si Si20 1 0.46815292 0.60825355 0.24885714 1.0 Si Si21 1 0.53464084 0.39197077 0.75380597 1.0 Si Si22 1 0.28843911 0.86930304 0.75047990 1.0 Si Si23 1 0.71233069 0.13372103 0.24927868 1.0 Si Si24 1 0.22157980 0.37084281 0.24745033 1.0 Si Si25 1 0.77751252 0.62929141 0.75372119 1.0 Si Si26 1 0.83224342 0.52986290 0.45967072 1.0 Si Si27 1 0.34304124 0.96460715 0.46035097 1.0 Si Si28 1 0.84069841 0.53204678 0.03841085 1.0 Si Si29 1 0.65786472 0.03084395 0.53888677 1.0 Si Si30 1 0.16035300 0.46868929 0.96168748 1.0 Si Si31 1 0.65661937 0.03301815 0.96080036 1.0 Si Si32 1 0.34321685 0.96854930 0.03981340 1.0 Pt Pt33 1 0.03394760 0.11213543 0.74710000 1.0 Pt Pt34 1 0.96929735 0.89314231 0.25025883 1.0 Pt Pt35 1 0.15812593 0.46612996 0.53979087 1.0