# generated using pymatgen data_Sc5P12Ru15Rh4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.34643251 _cell_length_b 12.34643339 _cell_length_c 3.89233068 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000288 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5P12Ru15Rh4 _chemical_formula_sum 'Sc5 P12 Ru15 Rh4' _cell_volume 513.83461024 _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 0.33333300 0.66666700 0.00000000 1.0 Sc Sc1 1 0.66666700 0.33333300 0.00000000 1.0 Sc Sc2 1 0.81337308 0.99968897 0.50000000 1.0 Sc Sc3 1 0.00031103 0.81368311 0.50000000 1.0 Sc Sc4 1 0.18631689 0.18662692 0.50000000 1.0 P P5 1 0.17893838 0.99662686 0.00000000 1.0 P P6 1 0.00337314 0.18231151 0.00000000 1.0 P P7 1 0.81768849 0.82106162 0.00000000 1.0 P P8 1 0.17246387 0.47933942 0.50000000 1.0 P P9 1 0.52066058 0.69312445 0.50000000 1.0 P P10 1 0.30687555 0.82753613 0.50000000 1.0 P P11 1 0.68676402 0.51815465 0.50000000 1.0 P P12 1 0.83138963 0.31323598 0.50000000 1.0 P P13 1 0.48184535 0.16861037 0.50000000 1.0 P P14 1 0.62700029 0.99664057 0.00000000 1.0 P P15 1 0.00335943 0.63035873 0.00000000 1.0 P P16 1 0.36964127 0.37299971 0.00000000 1.0 Ru Ru17 1 0.44941846 0.00798529 0.00000000 1.0 Ru Ru18 1 0.99201471 0.44143317 0.00000000 1.0 Ru Ru19 1 0.55856683 0.55058154 0.00000000 1.0 Ru Ru20 1 0.36654311 0.49216590 0.50000000 1.0 Ru Ru21 1 0.50783410 0.87437721 0.50000000 1.0 Ru Ru22 1 0.12562279 0.63345689 0.50000000 1.0 Ru Ru23 1 0.86938141 0.51012900 0.50000000 1.0 Ru Ru24 1 0.64074659 0.13061859 0.50000000 1.0 Ru Ru25 1 0.48987100 0.35925341 0.50000000 1.0 Ru Ru26 1 0.18310145 0.37676764 0.00000000 1.0 Ru Ru27 1 0.62323236 0.80633581 0.00000000 1.0 Ru Ru28 1 0.19366419 0.81689855 0.00000000 1.0 Ru Ru29 1 0.28039647 0.00219884 0.50000000 1.0 Ru Ru30 1 0.99780116 0.27819763 0.50000000 1.0 Ru Ru31 1 0.72180237 0.71960353 0.50000000 1.0 Rh Rh32 1 0.81496660 0.63014420 0.00000000 1.0 Rh Rh33 1 0.81517760 0.18503340 0.00000000 1.0 Rh Rh34 1 0.36985580 0.18482240 0.00000000 1.0 Rh Rh35 1 0.00000000 0.00000000 0.00000000 1.0