# generated using pymatgen data_LaFeAsO _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.14459300 _cell_length_b 10.11502346 _cell_length_c 8.24135832 _cell_angle_alpha 65.55564015 _cell_angle_beta 90.00027006 _cell_angle_gamma 89.99992706 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaFeAsO _chemical_formula_sum 'La4 Fe4 As4 O4' _cell_volume 314.53026605 _cell_formula_units_Z 4 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 0.74918400 0.86956400 0.69096700 1.0 La La1 1 0.75081100 0.86951500 0.19097600 1.0 La La2 1 0.24916300 0.13045800 0.30901700 1.0 La La3 1 0.25080300 0.13049000 0.80903800 1.0 Fe Fe4 1 0.75917600 0.49858800 0.12366100 1.0 Fe Fe5 1 0.25924000 0.50141200 0.87633300 1.0 Fe Fe6 1 0.74076000 0.49873100 0.62356900 1.0 Fe Fe7 1 0.24080200 0.50127900 0.37645000 1.0 As As8 1 0.75082800 0.32827300 0.95619300 1.0 As As9 1 0.74924400 0.32815100 0.45630900 1.0 As As10 1 0.25082900 0.67169000 0.04379900 1.0 As As11 1 0.24920500 0.67185100 0.54368100 1.0 O O12 1 0.74950400 0.00026400 0.37472200 1.0 O O13 1 0.75047300 0.00026100 0.87474600 1.0 O O14 1 0.25047100 0.99972300 0.12526700 1.0 O O15 1 0.24950800 0.99975000 0.62527200 1.0