# generated using pymatgen data_Li5Co17(P6Ru)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.65320611 _cell_length_b 11.61207019 _cell_length_c 3.54971680 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.88329078 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Co17(P6Ru)2 _chemical_formula_sum 'Li5 Co17 P12 Ru2' _cell_volume 416.47502655 _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 Li Li0 1 0.66546383 0.33270925 0.00000000 1.0 Li Li1 1 0.33453617 0.66724642 0.00000000 1.0 Li Li2 1 0.18183101 0.18258278 0.50000000 1.0 Li Li3 1 0.81816899 0.00075177 0.50000000 1.0 Li Li4 1 1.00000000 0.81708048 0.50000000 1.0 Co Co5 1 0.00000000 0.45256578 0.00000000 1.0 Co Co6 1 0.82292589 0.20178060 0.00000000 1.0 Co Co7 1 0.80300503 0.62177696 0.00000000 1.0 Co Co8 1 0.37333386 0.17773847 0.00000000 1.0 Co Co9 1 0.19699497 0.81877193 0.00000000 1.0 Co Co10 1 0.62666614 0.80440361 0.00000000 1.0 Co Co11 1 0.17707411 0.37885471 0.00000000 1.0 Co Co12 1 0.64893122 0.12686508 0.50000000 1.0 Co Co13 1 0.87431253 0.51973114 0.50000000 1.0 Co Co14 1 0.47836599 0.35109257 0.50000000 1.0 Co Co15 1 0.12568747 0.64541861 0.50000000 1.0 Co Co16 1 0.52163401 0.87272658 0.50000000 1.0 Co Co17 1 0.35106878 0.47793385 0.50000000 1.0 Co Co18 1 0.71884817 0.71712655 0.50000000 1.0 Co Co19 1 0.28115183 0.99827938 0.50000000 1.0 Co Co20 1 1.00000000 0.28701923 0.50000000 1.0 Co Co21 1 1.00000000 0.00241473 0.00000000 1.0 P P22 1 0.35401499 0.35538036 0.00000000 1.0 P P23 1 0.64598501 0.00136537 0.00000000 1.0 P P24 1 1.00000000 0.64073318 0.00000000 1.0 P P25 1 0.83179710 0.31889565 0.50000000 1.0 P P26 1 0.68241735 0.51256123 0.50000000 1.0 P P27 1 0.48466698 0.16690489 0.50000000 1.0 P P28 1 0.31758265 0.83014388 0.50000000 1.0 P P29 1 0.51533302 0.68223791 0.50000000 1.0 P P30 1 0.16820290 0.48709755 0.50000000 1.0 P P31 1 0.82448685 0.82208717 0.00000000 1.0 P P32 1 0.17551315 0.99759932 0.00000000 1.0 P P33 1 1.00000000 0.18092440 0.00000000 1.0 Ru Ru34 1 0.54978491 0.54949227 0.00000000 1.0 Ru Ru35 1 0.45021509 0.99970736 0.00000000 1.0