# generated using pymatgen data_Tb6PrS8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.84856156 _cell_length_b 7.87783505 _cell_length_c 7.90249946 _cell_angle_alpha 120.10362222 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.87715812 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb6PrS8 _chemical_formula_sum 'Tb6 Pr1 S8' _cell_volume 345.59770398 _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 0.24999537 0.00000277 0.24999598 1.0 Tb Tb1 1 0.75000840 0.00000277 0.24999698 1.0 Tb Tb2 1 0.24999825 0.49999551 0.74999925 1.0 Tb Tb3 1 0.24999637 0.00000277 0.75000779 1.0 Tb Tb4 1 0.75000840 0.00000277 0.75000779 1.0 Tb Tb5 1 0.75000243 0.50000587 0.75000243 1.0 Pr Pr6 1 0.24999447 0.49998894 0.24999447 1.0 S S7 1 0.99469769 0.98939538 0.99469769 1.0 S S8 1 0.50530218 0.01060337 0.50530218 1.0 S S9 1 0.00076022 0.00152145 0.50076222 1.0 S S10 1 0.99607281 0.50000105 0.50665084 1.0 S S11 1 0.50392824 0.50000105 0.50665084 1.0 S S12 1 0.99607481 0.50000105 0.99335120 1.0 S S13 1 0.50392624 0.50000105 0.99335120 1.0 S S14 1 0.49923712 0.99847423 0.99923812 1.0