# generated using pymatgen data_Tb5P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.98196500 _cell_length_b 12.55713310 _cell_length_c 12.55729874 _cell_angle_alpha 119.99956226 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5P12Ru19 _chemical_formula_sum 'Tb5 P12 Ru19' _cell_volume 543.77183514 _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 Tb Tb0 1 0.50000000 0.99999700 0.18457000 1.0 Tb Tb1 1 0.50000000 0.18456200 0.00000000 1.0 Tb Tb2 1 0.50000000 0.81542800 0.81543000 1.0 Tb Tb3 1 0.00000000 0.33330400 0.66667400 1.0 Tb Tb4 1 0.00000000 0.66663000 0.33332600 1.0 P P5 1 0.00000000 0.99999700 0.81555700 1.0 P P6 1 0.00000000 0.81556900 0.00000000 1.0 P P7 1 0.00000000 0.18443900 0.18444300 1.0 P P8 1 0.50000000 0.30732000 0.47756900 1.0 P P9 1 0.50000000 0.17023300 0.69266900 1.0 P P10 1 0.50000000 0.52243200 0.82976100 1.0 P P11 1 0.50000000 0.82975100 0.52243100 1.0 P P12 1 0.50000000 0.47756300 0.30733100 1.0 P P13 1 0.50000000 0.69267200 0.17023900 1.0 P P14 1 0.00000000 0.00000400 0.37272500 1.0 P P15 1 0.00000000 0.37271700 0.00000000 1.0 P P16 1 0.00000000 0.62727900 0.62727500 1.0 Ru Ru17 1 0.00000000 0.00000200 0.55443100 1.0 Ru Ru18 1 0.00000000 0.55443000 0.00000000 1.0 Ru Ru19 1 0.00000000 0.44557100 0.44556900 1.0 Ru Ru20 1 0.50000000 0.99999900 0.71705100 1.0 Ru Ru21 1 0.50000000 0.71705500 0.00000000 1.0 Ru Ru22 1 0.50000000 0.28294800 0.28294900 1.0 Ru Ru23 1 0.00000000 0.19255600 0.37699700 1.0 Ru Ru24 1 0.00000000 0.18444300 0.80745000 1.0 Ru Ru25 1 0.00000000 0.62300800 0.81556100 1.0 Ru Ru26 1 0.00000000 0.81555900 0.62300300 1.0 Ru Ru27 1 0.00000000 0.37699300 0.19255000 1.0 Ru Ru28 1 0.00000000 0.80744700 0.18443900 1.0 Ru Ru29 1 0.50000000 0.12599700 0.49110100 1.0 Ru Ru30 1 0.50000000 0.36509900 0.87400400 1.0 Ru Ru31 1 0.50000000 0.50889600 0.63489500 1.0 Ru Ru32 1 0.50000000 0.63489600 0.50889900 1.0 Ru Ru33 1 0.50000000 0.49109500 0.12599600 1.0 Ru Ru34 1 0.50000000 0.87400100 0.36510500 1.0 Ru Ru35 1 0.00000000 0.00000700 0.00000000 1.0