# generated using pymatgen data_Hf11Ta9Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.86974422 _cell_length_b 6.86780458 _cell_length_c 12.61972012 _cell_angle_alpha 90.12879464 _cell_angle_beta 89.88263878 _cell_angle_gamma 90.00578139 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf11Ta9Si16 _chemical_formula_sum 'Hf11 Ta9 Si16' _cell_volume 595.39640632 _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 Hf Hf0 1 0.50063829 0.35091870 0.62258534 1.0 Hf Hf1 1 0.50104776 0.64959133 0.12403481 1.0 Hf Hf2 1 0.14845357 0.99943860 0.87343624 1.0 Hf Hf3 1 0.00178572 0.65751213 0.03166060 1.0 Hf Hf4 1 0.99797287 0.34148076 0.52901587 1.0 Hf Hf5 1 0.66102237 0.00062539 0.96985557 1.0 Hf Hf6 1 0.15721398 0.49833165 0.77986546 1.0 Hf Hf7 1 0.84217113 0.50144755 0.28067750 1.0 Hf Hf8 1 0.50010129 0.16099150 0.22086861 1.0 Hf Hf9 1 0.50132182 0.83889198 0.71895222 1.0 Hf Hf10 1 0.33831569 0.00003725 0.46931562 1.0 Ta Ta11 1 0.34863326 0.50583089 0.37675655 1.0 Ta Ta12 1 0.85124422 0.99851201 0.37382964 1.0 Ta Ta13 1 0.00591029 0.15168320 0.12666949 1.0 Ta Ta14 1 0.99380358 0.84937076 0.62679565 1.0 Ta Ta15 1 0.65164505 0.49310472 0.87656499 1.0 Ta Ta16 1 0.67143258 0.67322893 0.49916102 1.0 Ta Ta17 1 0.82759456 0.17030107 0.74948805 1.0 Ta Ta18 1 0.17171578 0.83179182 0.25123412 1.0 Ta Ta19 1 0.32977810 0.32721842 0.00032944 1.0 Si Si20 1 0.04405250 0.70157218 0.43605788 1.0 Si Si21 1 0.95501500 0.30106980 0.93621990 1.0 Si Si22 1 0.69935553 0.04420878 0.56292662 1.0 Si Si23 1 0.19982076 0.45468263 0.18660671 1.0 Si Si24 1 0.80070987 0.54567365 0.68565114 1.0 Si Si25 1 0.45562499 0.19786920 0.81422467 1.0 Si Si26 1 0.54653040 0.80269556 0.31488305 1.0 Si Si27 1 0.30209320 0.95589448 0.06491641 1.0 Si Si28 1 0.85721451 0.78864154 0.82272610 1.0 Si Si29 1 0.13797374 0.21005736 0.32328065 1.0 Si Si30 1 0.79720493 0.86450630 0.17833098 1.0 Si Si31 1 0.28870211 0.64200531 0.57241504 1.0 Si Si32 1 0.71062690 0.35736782 0.07282610 1.0 Si Si33 1 0.63746532 0.29308725 0.42523048 1.0 Si Si34 1 0.36273757 0.70249711 0.92650822 1.0 Si Si35 1 0.20307376 0.13785937 0.67609526 1.0