# generated using pymatgen data_Ho6TaP12Rh17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.91235512 _cell_length_b 11.08522510 _cell_length_c 12.67446317 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho6TaP12Rh17 _chemical_formula_sum 'Ho6 Ta1 P12 Rh17' _cell_volume 549.68306647 _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 Ho Ho0 1 0.00000000 0.50000000 0.52179349 1.0 Ho Ho1 1 0.50000000 0.00000000 0.47712267 1.0 Ho Ho2 1 0.50000000 0.81641242 0.20661866 1.0 Ho Ho3 1 0.50000000 0.18358758 0.20661866 1.0 Ho Ho4 1 0.00000000 0.68092878 0.79611167 1.0 Ho Ho5 1 0.00000000 0.31907122 0.79611167 1.0 Ta Ta6 1 0.50000000 0.50000000 0.15874284 1.0 P P7 1 0.50000000 0.31503883 0.61928303 1.0 P P8 1 0.50000000 0.68496117 0.61928303 1.0 P P9 1 0.00000000 0.18522855 0.38275574 1.0 P P10 1 0.00000000 0.81477145 0.38275574 1.0 P P11 1 0.50000000 0.50000000 0.87434284 1.0 P P12 1 0.00000000 0.00000000 0.12134685 1.0 P P13 1 0.50000000 0.84800883 0.88962145 1.0 P P14 1 0.50000000 0.15199117 0.88962145 1.0 P P15 1 0.00000000 0.65574599 0.10982001 1.0 P P16 1 0.00000000 0.34425401 0.10982001 1.0 P P17 1 0.50000000 0.50000000 0.35166172 1.0 P P18 1 0.00000000 0.00000000 0.64903349 1.0 Rh Rh19 1 0.00000000 0.50000000 0.98762541 1.0 Rh Rh20 1 0.50000000 0.00000000 0.01793893 1.0 Rh Rh21 1 0.50000000 0.29124360 0.43429170 1.0 Rh Rh22 1 0.50000000 0.70875640 0.43429170 1.0 Rh Rh23 1 0.00000000 0.19961169 0.56983160 1.0 Rh Rh24 1 0.00000000 0.80038831 0.56983160 1.0 Rh Rh25 1 0.50000000 0.87365242 0.71012903 1.0 Rh Rh26 1 0.50000000 0.12634758 0.71012903 1.0 Rh Rh27 1 0.00000000 0.62717352 0.29145645 1.0 Rh Rh28 1 0.00000000 0.37282648 0.29145645 1.0 Rh Rh29 1 0.50000000 0.33167106 0.98432724 1.0 Rh Rh30 1 0.50000000 0.66832894 0.98432724 1.0 Rh Rh31 1 0.00000000 0.16718275 0.01205521 1.0 Rh Rh32 1 0.00000000 0.83281725 0.01205521 1.0 Rh Rh33 1 0.00000000 0.00000000 0.83118192 1.0 Rh Rh34 1 0.50000000 0.50000000 0.69734892 1.0 Rh Rh35 1 0.00000000 0.00000000 0.29925335 1.0