# generated using pymatgen data_Ge8Pd21 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.99900025 _cell_length_b 10.52585394 _cell_length_c 10.52456098 _cell_angle_alpha 76.95796383 _cell_angle_beta 61.64474194 _cell_angle_gamma 61.63841970 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ge8Pd21 _chemical_formula_sum 'Ge16 Pd42' _cell_volume 857.78183490 _cell_formula_units_Z 2 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 Ge Ge0 1 0.56708245 0.03029205 0.77810231 1.0 Ge Ge1 1 0.72622621 0.64367830 0.55011585 1.0 Ge Ge2 1 0.65484761 0.27807753 0.96973379 1.0 Ge Ge3 1 0.43291755 0.96970795 0.22189769 1.0 Ge Ge4 1 0.08009614 0.14354723 0.05017119 1.0 Ge Ge5 1 0.13012413 0.44978252 0.14360110 1.0 Ge Ge6 1 0.86987587 0.55021748 0.85639890 1.0 Ge Ge7 1 0.91990386 0.85645177 0.94982881 1.0 Ge Ge8 1 0.27644269 0.94976497 0.64355057 1.0 Ge Ge9 1 0.09726071 0.77816583 0.46984631 1.0 Ge Ge10 1 0.27377379 0.35632170 0.44988415 1.0 Ge Ge11 1 0.72355731 0.05023503 0.35644943 1.0 Ge Ge12 1 0.34515239 0.72192247 0.03026621 1.0 Ge Ge13 1 0.37551633 0.46977154 0.72183594 1.0 Ge Ge14 1 0.62448367 0.53022846 0.27816406 1.0 Ge Ge15 1 0.90273929 0.22183417 0.53015369 1.0 Pd Pd16 1 0.01823251 0.40551961 0.41197755 1.0 Pd Pd17 1 0.83158247 0.23130866 0.32618219 1.0 Pd Pd18 1 0.15777641 0.17388043 0.23124304 1.0 Pd Pd19 1 0.38893273 0.26881118 0.17394865 1.0 Pd Pd20 1 0.56983394 0.91196438 0.59445331 1.0 Pd Pd21 1 0.60598655 0.51626331 0.04381092 1.0 Pd Pd22 1 0.93276190 0.28549598 0.89296154 1.0 Pd Pd23 1 0.83388075 0.01629611 0.54391930 1.0 Pd Pd24 1 0.17427246 0.39300080 0.71447990 1.0 Pd Pd25 1 0.23595286 0.55945509 0.27493804 1.0 Pd Pd26 1 0.39401345 0.48373669 0.95618908 1.0 Pd Pd27 1 0.29556415 0.27478076 0.94050246 1.0 Pd Pd28 1 0.51082995 0.22509193 0.55950957 1.0 Pd Pd29 1 0.43713170 0.67388589 0.73123135 1.0 Pd Pd30 1 0.92969356 0.05930441 0.77465282 1.0 Pd Pd31 1 0.88870060 0.78566734 0.39303570 1.0 Pd Pd32 1 0.28176945 0.10683994 0.78559449 1.0 Pd Pd33 1 0.92368706 0.41194694 0.09444741 1.0 Pd Pd34 1 0.98176749 0.59448039 0.58802245 1.0 Pd Pd35 1 0.35016386 0.54378613 0.48376991 1.0 Pd Pd36 1 0.76404714 0.44054491 0.72506196 1.0 Pd Pd37 1 0.64983614 0.45621387 0.51623009 1.0 Pd Pd38 1 0.71823055 0.89316006 0.21440451 1.0 Pd Pd39 1 0.84222359 0.82611957 0.76875696 1.0 Pd Pd40 1 0.06723810 0.71450402 0.10703846 1.0 Pd Pd41 1 0.61106727 0.73118882 0.82605135 1.0 Pd Pd42 1 0.83580692 0.09450943 0.08809593 1.0 Pd Pd43 1 0.16419308 0.90549057 0.91190407 1.0 Pd Pd44 1 0.62505401 0.25005808 0.74991551 1.0 Pd Pd45 1 0.16611925 0.98370389 0.45608070 1.0 Pd Pd46 1 0.37788471 0.95598926 0.01627848 1.0 Pd Pd47 1 0.70443585 0.72521924 0.05949754 1.0 Pd Pd48 1 0.56286830 0.32611411 0.26876865 1.0 Pd Pd49 1 0.62211529 0.04401074 0.98372152 1.0 Pd Pd50 1 0.07030644 0.94069559 0.22534718 1.0 Pd Pd51 1 0.11129940 0.21433266 0.60696430 1.0 Pd Pd52 1 0.07631194 0.58805306 0.90555259 1.0 Pd Pd53 1 0.16841753 0.76869134 0.67381781 1.0 Pd Pd54 1 0.43016606 0.08803562 0.40554669 1.0 Pd Pd55 1 0.37494599 0.74994192 0.25008449 1.0 Pd Pd56 1 0.48916905 0.77490807 0.44049043 1.0 Pd Pd57 1 0.82572754 0.60699920 0.28552010 1.0