# generated using pymatgen data_Ho5P12Ir13Ru6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.52973287 _cell_length_b 12.52602627 _cell_length_c 3.95195852 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.70526801 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho5P12Ir13Ru6 _chemical_formula_sum 'Ho5 P12 Ir13 Ru6' _cell_volume 538.74135121 _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 0.66802287 0.33361227 0.00000000 1.0 Ho Ho1 1 0.33279721 0.66516881 0.00000000 1.0 Ho Ho2 1 0.81794961 0.00179359 0.50000000 1.0 Ho Ho3 1 0.18206540 0.18331841 0.50000000 1.0 Ho Ho4 1 0.99957620 0.81711069 0.50000000 1.0 P P5 1 0.64515943 0.00497900 0.00000000 1.0 P P6 1 0.36326294 0.36287853 0.00000000 1.0 P P7 1 0.99941235 0.63666968 0.00000000 1.0 P P8 1 0.68843025 0.51962139 0.50000000 1.0 P P9 1 0.82986582 0.30817706 0.50000000 1.0 P P10 1 0.30918968 0.82906029 0.50000000 1.0 P P11 1 0.51928647 0.68623253 0.50000000 1.0 P P12 1 0.18185178 0.00106607 0.00000000 1.0 P P13 1 0.81940206 0.82008743 0.00000000 1.0 P P14 1 0.99735432 0.18104300 0.00000000 1.0 P P15 1 0.48078955 0.17082703 0.50000000 1.0 P P16 1 0.16745118 0.48037138 0.50000000 1.0 Ir Ir17 1 0.62564123 0.80835070 0.00000000 1.0 Ir Ir18 1 0.18198481 0.37480945 0.00000000 1.0 Ir Ir19 1 0.37748070 0.18220659 0.00000000 1.0 Ir Ir20 1 0.19377548 0.81805653 0.00000000 1.0 Ir Ir21 1 0.80517447 0.62404736 0.00000000 1.0 Ir Ir22 1 0.86776178 0.50564728 0.50000000 1.0 Ir Ir23 1 0.49285145 0.36350245 0.50000000 1.0 Ir Ir24 1 0.63664745 0.12898826 0.50000000 1.0 Ir Ir25 1 0.12939074 0.63820153 0.50000000 1.0 Ir Ir26 1 0.35970639 0.49219700 0.50000000 1.0 Ir Ir27 1 0.50376239 0.86375619 0.50000000 1.0 Ir Ir28 1 0.00043237 0.00009778 0.00000000 1.0 Ir Ir29 1 0.45815482 0.99577444 0.00000000 1.0 Ru Ru30 1 0.71325826 0.71346075 0.50000000 1.0 Ru Ru31 1 0.00157959 0.28864957 0.50000000 1.0 Ru Ru32 1 0.54327730 0.54698491 0.00000000 1.0 Ru Ru33 1 0.00149871 0.45519916 0.00000000 1.0 Ru Ru34 1 0.81947877 0.19785463 0.00000000 1.0 Ru Ru35 1 0.28627516 0.00019724 0.50000000 1.0