# generated using pymatgen data_TbLuP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.33935611 _cell_length_b 9.33935496 _cell_length_c 3.92471856 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000062 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbLuP7Ru12 _chemical_formula_sum 'Tb1 Lu1 P7 Ru12' _cell_volume 296.46468311 _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 0.33333300 0.66666700 0.00000000 1.0 Lu Lu1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60137599 0.71834243 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28165757 0.88303456 0.50000000 1.0 P P5 1 0.11696544 0.39862401 0.50000000 1.0 P P6 1 0.88496092 0.57323584 0.00000000 1.0 P P7 1 0.42676416 0.31172508 0.00000000 1.0 P P8 1 0.68827492 0.11503908 0.00000000 1.0 Ru Ru9 1 0.55733366 0.95137312 0.50000000 1.0 Ru Ru10 1 0.39404046 0.44266634 0.50000000 1.0 Ru Ru11 1 0.91481447 0.12105012 0.50000000 1.0 Ru Ru12 1 0.20623665 0.08518553 0.50000000 1.0 Ru Ru13 1 0.87894988 0.79376335 0.50000000 1.0 Ru Ru14 1 0.72778347 0.89151583 0.00000000 1.0 Ru Ru15 1 0.10848417 0.83626664 0.00000000 1.0 Ru Ru16 1 0.16373336 0.27221653 0.00000000 1.0 Ru Ru17 1 0.42493957 0.06871682 0.00000000 1.0 Ru Ru18 1 0.93128318 0.35622375 0.00000000 1.0 Ru Ru19 1 0.64377625 0.57506043 0.00000000 1.0 Ru Ru20 1 0.04862688 0.60595954 0.50000000 1.0