# generated using pymatgen data_Pr6YGeI12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.97732689 _cell_length_b 9.97732780 _cell_length_c 9.97732771 _cell_angle_alpha 107.61571657 _cell_angle_beta 107.61570825 _cell_angle_gamma 107.61569996 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr6YGeI12 _chemical_formula_sum 'Pr6 Y1 Ge1 I12' _cell_volume 812.86495171 _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 Pr Pr0 1 0.96542183 0.89444836 0.68373481 1.0 Pr Pr1 1 0.03457817 0.10555164 0.31626519 1.0 Pr Pr2 1 0.10555164 0.31626519 0.03457817 1.0 Pr Pr3 1 0.31626519 0.03457817 0.10555164 1.0 Pr Pr4 1 0.89444836 0.68373481 0.96542183 1.0 Pr Pr5 1 0.68373481 0.96542183 0.89444836 1.0 Y Y6 1 0.50000000 0.50000000 0.50000000 1.0 Ge Ge7 1 0.00000000 0.00000000 0.00000000 1.0 I I8 1 0.52423570 0.60204804 0.83321965 1.0 I I9 1 0.47576430 0.39795196 0.16678035 1.0 I I10 1 0.31238457 0.92115985 0.76723918 1.0 I I11 1 0.39795196 0.16678035 0.47576430 1.0 I I12 1 0.92115985 0.76723918 0.31238457 1.0 I I13 1 0.68761543 0.07884015 0.23276082 1.0 I I14 1 0.07884015 0.23276082 0.68761543 1.0 I I15 1 0.76723918 0.31238457 0.92115985 1.0 I I16 1 0.23276082 0.68761543 0.07884015 1.0 I I17 1 0.83321965 0.52423570 0.60204804 1.0 I I18 1 0.16678035 0.47576430 0.39795196 1.0 I I19 1 0.60204804 0.83321965 0.52423570 1.0