# generated using pymatgen data_Tb3Co2P6Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.85745502 _cell_length_b 10.84725249 _cell_length_c 12.61893055 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Co2P6Ru7 _chemical_formula_sum 'Tb6 Co4 P12 Ru14' _cell_volume 528.01124293 _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 0.52656969 1.0 Tb Tb1 1 0.50000000 0.00000000 0.47259934 1.0 Tb Tb2 1 0.50000000 0.82123452 0.20291155 1.0 Tb Tb3 1 0.50000000 0.17876548 0.20291155 1.0 Tb Tb4 1 0.00000000 0.68184146 0.79827279 1.0 Tb Tb5 1 0.00000000 0.31815854 0.79827279 1.0 Co Co6 1 0.00000000 0.50000000 0.98830743 1.0 Co Co7 1 0.50000000 0.00000000 0.01264854 1.0 Co Co8 1 0.00000000 0.16182791 0.01027168 1.0 Co Co9 1 0.00000000 0.83817209 0.01027168 1.0 P P10 1 0.50000000 0.30512258 0.61602084 1.0 P P11 1 0.50000000 0.69487742 0.61602084 1.0 P P12 1 0.00000000 0.19546865 0.38428978 1.0 P P13 1 0.00000000 0.80453135 0.38428978 1.0 P P14 1 0.50000000 0.50000000 0.88639687 1.0 P P15 1 0.00000000 0.00000000 0.11267003 1.0 P P16 1 0.50000000 0.85184733 0.89703450 1.0 P P17 1 0.50000000 0.14815267 0.89703450 1.0 P P18 1 0.00000000 0.65619957 0.10026115 1.0 P P19 1 0.00000000 0.34380043 0.10026115 1.0 P P20 1 0.50000000 0.50000000 0.33461108 1.0 P P21 1 0.00000000 0.00000000 0.66466840 1.0 Ru Ru22 1 0.50000000 0.29975250 0.42862343 1.0 Ru Ru23 1 0.50000000 0.70024750 0.42862343 1.0 Ru Ru24 1 0.00000000 0.20020333 0.57167844 1.0 Ru Ru25 1 0.00000000 0.79979667 0.57167844 1.0 Ru Ru26 1 0.50000000 0.87843651 0.71637218 1.0 Ru Ru27 1 0.50000000 0.12156349 0.71637218 1.0 Ru Ru28 1 0.00000000 0.62285585 0.28162611 1.0 Ru Ru29 1 0.00000000 0.37714415 0.28162611 1.0 Ru Ru30 1 0.50000000 0.32722299 0.99213297 1.0 Ru Ru31 1 0.50000000 0.67277701 0.99213297 1.0 Ru Ru32 1 0.50000000 0.50000000 0.15145992 1.0 Ru Ru33 1 0.00000000 0.00000000 0.85178927 1.0 Ru Ru34 1 0.50000000 0.50000000 0.69946697 1.0 Ru Ru35 1 0.00000000 0.00000000 0.29982159 1.0