# generated using pymatgen data_Dy6Mn5P12Ir13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92200531 _cell_length_b 11.05168275 _cell_length_c 12.75526083 _cell_angle_alpha 90.21738777 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy6Mn5P12Ir13 _chemical_formula_sum 'Dy6 Mn5 P12 Ir13' _cell_volume 552.86971926 _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 Dy Dy0 1 0.00000000 0.50093116 0.52050456 1.0 Dy Dy1 1 0.50000000 0.99837329 0.47960193 1.0 Dy Dy2 1 0.50000000 0.82167045 0.20019435 1.0 Dy Dy3 1 0.50000000 0.17973453 0.20444489 1.0 Dy Dy4 1 0.00000000 0.67831653 0.79692967 1.0 Dy Dy5 1 0.00000000 0.32028381 0.79508804 1.0 Mn Mn6 1 0.50000000 0.49715250 0.16599172 1.0 Mn Mn7 1 0.00000000 0.00220463 0.83831434 1.0 Mn Mn8 1 0.00000000 0.49450439 0.98866985 1.0 Mn Mn9 1 0.50000000 0.00260436 0.00975629 1.0 Mn Mn10 1 0.50000000 0.33533453 0.99705136 1.0 P P11 1 0.50000000 0.49495393 0.87832368 1.0 P P12 1 0.00000000 0.00320950 0.11853223 1.0 P P13 1 0.50000000 0.49971386 0.35373402 1.0 P P14 1 0.00000000 0.99891767 0.64877830 1.0 P P15 1 0.50000000 0.31245744 0.61852796 1.0 P P16 1 0.50000000 0.68709896 0.61754963 1.0 P P17 1 0.00000000 0.18594573 0.38252943 1.0 P P18 1 0.00000000 0.81446540 0.37940239 1.0 P P19 1 0.50000000 0.84519988 0.89503659 1.0 P P20 1 0.50000000 0.15533491 0.89248718 1.0 P P21 1 0.00000000 0.65362940 0.10254692 1.0 P P22 1 0.00000000 0.34789405 0.11300215 1.0 Ir Ir23 1 0.50000000 0.49991984 0.69654945 1.0 Ir Ir24 1 0.00000000 0.00184900 0.29965673 1.0 Ir Ir25 1 0.50000000 0.65985172 0.99365058 1.0 Ir Ir26 1 0.00000000 0.17134734 0.00487533 1.0 Ir Ir27 1 0.00000000 0.83809850 0.00495119 1.0 Ir Ir28 1 0.50000000 0.29121419 0.43251819 1.0 Ir Ir29 1 0.50000000 0.70477296 0.42911873 1.0 Ir Ir30 1 0.00000000 0.20477521 0.57049234 1.0 Ir Ir31 1 0.00000000 0.79505749 0.56819524 1.0 Ir Ir32 1 0.50000000 0.86963288 0.71513359 1.0 Ir Ir33 1 0.50000000 0.12552439 0.71222386 1.0 Ir Ir34 1 0.00000000 0.63159780 0.28154846 1.0 Ir Ir35 1 0.00000000 0.37642878 0.29408883 1.0