# generated using pymatgen data_Tb2P7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35425726 _cell_length_b 9.35425699 _cell_length_c 3.93503429 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999403 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2P7Ru12 _chemical_formula_sum 'Tb2 P7 Ru12' _cell_volume 298.19323444 _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 0.66666700 0.33333300 0.50000000 1.0 Tb Tb1 1 0.33333300 0.66666700 0.00000000 1.0 P P2 1 0.60140011 0.71698377 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28301623 0.88441634 0.50000000 1.0 P P5 1 0.11558366 0.39859989 0.50000000 1.0 P P6 1 0.88667042 0.57595537 0.00000000 1.0 P P7 1 0.42404463 0.31071406 0.00000000 1.0 P P8 1 0.68928594 0.11332958 0.00000000 1.0 Ru Ru9 1 0.55751598 0.94959381 0.50000000 1.0 Ru Ru10 1 0.39207883 0.44248402 0.50000000 1.0 Ru Ru11 1 0.91429019 0.12119666 0.50000000 1.0 Ru Ru12 1 0.20690647 0.08570981 0.50000000 1.0 Ru Ru13 1 0.87880334 0.79309353 0.50000000 1.0 Ru Ru14 1 0.72845082 0.89105663 0.00000000 1.0 Ru Ru15 1 0.10894337 0.83739319 0.00000000 1.0 Ru Ru16 1 0.16260681 0.27154918 0.00000000 1.0 Ru Ru17 1 0.42431355 0.06640606 0.00000000 1.0 Ru Ru18 1 0.93359394 0.35790849 0.00000000 1.0 Ru Ru19 1 0.64209151 0.57568645 0.00000000 1.0 Ru Ru20 1 0.05040619 0.60792117 0.50000000 1.0