# generated using pymatgen data_La5Mo3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.77509742 _cell_length_b 12.77509733 _cell_length_c 4.03207224 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000023 _symmetry_Int_Tables_number 1 _chemical_formula_structural La5Mo3(P3Ir4)4 _chemical_formula_sum 'La5 Mo3 P12 Ir16' _cell_volume 569.88519285 _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 La La0 1 0.18758702 0.18758702 0.50000000 1.0 La La1 1 0.81241298 0.00000000 0.50000000 1.0 La La2 1 0.00000000 0.81241298 0.50000000 1.0 La La3 1 0.33333300 0.66666700 0.00000000 1.0 La La4 1 0.66666700 0.33333300 0.00000000 1.0 Mo Mo5 1 0.54847679 0.54847679 0.00000000 1.0 Mo Mo6 1 0.45152321 0.00000000 0.00000000 1.0 Mo Mo7 1 0.00000000 0.45152321 0.00000000 1.0 P P8 1 0.82007884 0.82007884 0.00000000 1.0 P P9 1 0.17992116 0.00000000 0.00000000 1.0 P P10 1 0.00000000 0.17992116 0.00000000 1.0 P P11 1 0.16653976 0.48087049 0.50000000 1.0 P P12 1 0.51912951 0.68567027 0.50000000 1.0 P P13 1 0.31432973 0.83346024 0.50000000 1.0 P P14 1 0.68567027 0.51912951 0.50000000 1.0 P P15 1 0.83346024 0.31432973 0.50000000 1.0 P P16 1 0.48087049 0.16653976 0.50000000 1.0 P P17 1 0.36701476 0.36701476 0.00000000 1.0 P P18 1 0.63298524 0.00000000 0.00000000 1.0 P P19 1 1.00000000 0.63298524 0.00000000 1.0 Ir Ir20 1 0.71278136 0.71278136 0.50000000 1.0 Ir Ir21 1 0.28721864 0.00000000 0.50000000 1.0 Ir Ir22 1 0.00000000 0.28721864 0.50000000 1.0 Ir Ir23 1 0.17816805 0.37769656 0.00000000 1.0 Ir Ir24 1 0.62230344 0.80047149 0.00000000 1.0 Ir Ir25 1 0.19952851 0.82183195 0.00000000 1.0 Ir Ir26 1 0.80047149 0.62230344 0.00000000 1.0 Ir Ir27 1 0.82183195 0.19952851 0.00000000 1.0 Ir Ir28 1 0.37769656 0.17816805 0.00000000 1.0 Ir Ir29 1 0.35976507 0.49024284 0.50000000 1.0 Ir Ir30 1 0.50975716 0.86952223 0.50000000 1.0 Ir Ir31 1 0.13047777 0.64023493 0.50000000 1.0 Ir Ir32 1 0.86952223 0.50975716 0.50000000 1.0 Ir Ir33 1 0.64023493 0.13047777 0.50000000 1.0 Ir Ir34 1 0.49024284 0.35976507 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0