# generated using pymatgen data_Tb3Co8P6Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.71579296 _cell_length_b 10.44328056 _cell_length_c 12.17464108 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Co8P6Ru _chemical_formula_sum 'Tb6 Co16 P12 Ru2' _cell_volume 472.43777937 _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 Tb Tb0 1 0.00000000 0.50000000 0.52309980 1.0 Tb Tb1 1 0.50000000 0.00000000 0.47690020 1.0 Tb Tb2 1 0.50000000 0.81705563 0.20730922 1.0 Tb Tb3 1 0.50000000 0.18294437 0.20730922 1.0 Tb Tb4 1 0.00000000 0.68294437 0.79269078 1.0 Tb Tb5 1 0.00000000 0.31705563 0.79269078 1.0 Co Co6 1 0.50000000 0.50000000 0.70334513 1.0 Co Co7 1 0.00000000 0.00000000 0.29665487 1.0 Co Co8 1 0.00000000 0.50000000 0.98621306 1.0 Co Co9 1 0.50000000 0.00000000 0.01378694 1.0 Co Co10 1 0.50000000 0.33192142 0.99069049 1.0 Co Co11 1 0.50000000 0.66807858 0.99069049 1.0 Co Co12 1 0.00000000 0.16807858 0.00930951 1.0 Co Co13 1 0.00000000 0.83192142 0.00930951 1.0 Co Co14 1 0.50000000 0.29943582 0.42920738 1.0 Co Co15 1 0.50000000 0.70056418 0.42920738 1.0 Co Co16 1 0.00000000 0.20056418 0.57079262 1.0 Co Co17 1 0.00000000 0.79943582 0.57079262 1.0 Co Co18 1 0.50000000 0.88121929 0.71096740 1.0 Co Co19 1 0.50000000 0.11878071 0.71096740 1.0 Co Co20 1 0.00000000 0.61878071 0.28903260 1.0 Co Co21 1 0.00000000 0.38121929 0.28903260 1.0 P P22 1 0.50000000 0.50000000 0.88233707 1.0 P P23 1 0.00000000 0.00000000 0.11766293 1.0 P P24 1 0.50000000 0.50000000 0.34641424 1.0 P P25 1 0.00000000 0.00000000 0.65358576 1.0 P P26 1 0.50000000 0.30797141 0.61442320 1.0 P P27 1 0.50000000 0.69202859 0.61442320 1.0 P P28 1 0.00000000 0.19202859 0.38557680 1.0 P P29 1 0.00000000 0.80797141 0.38557680 1.0 P P30 1 0.50000000 0.84652414 0.89451751 1.0 P P31 1 0.50000000 0.15347586 0.89451751 1.0 P P32 1 0.00000000 0.65347586 0.10548249 1.0 P P33 1 0.00000000 0.34652414 0.10548249 1.0 Ru Ru34 1 0.50000000 0.50000000 0.15410526 1.0 Ru Ru35 1 0.00000000 0.00000000 0.84589474 1.0