# generated using pymatgen data_La3(IO3)13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.76525928 _cell_length_b 13.76525928 _cell_length_c 13.76525944 _cell_angle_alpha 109.29745848 _cell_angle_beta 109.29745848 _cell_angle_gamma 109.29745664 _symmetry_Int_Tables_number 1 _chemical_formula_structural La3(IO3)13 _chemical_formula_sum 'La6 I26 O78' _cell_volume 2020.66423949 _cell_formula_units_Z 2 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 0.09383300 0.86475000 0.73855900 1.0 La La1 1 0.73855900 0.09383300 0.86475000 1.0 La La2 1 0.86475000 0.73855900 0.09383300 1.0 La La3 1 0.23855900 0.36475000 0.59383300 1.0 La La4 1 0.59383300 0.23855900 0.36475000 1.0 La La5 1 0.36475000 0.59383300 0.23855900 1.0 I I6 1 0.91691600 0.91691600 0.91691600 1.0 I I7 1 0.41691600 0.41691600 0.41691600 1.0 I I8 1 0.87107700 0.97905900 0.63841900 1.0 I I9 1 0.63841900 0.87107700 0.97905900 1.0 I I10 1 0.97905900 0.63841900 0.87107700 1.0 I I11 1 0.13841900 0.47905900 0.37107700 1.0 I I12 1 0.37107700 0.13841900 0.47905900 1.0 I I13 1 0.47905900 0.37107700 0.13841900 1.0 I I14 1 0.25577400 0.20296200 0.79840700 1.0 I I15 1 0.79840700 0.25577400 0.20296200 1.0 I I16 1 0.20296200 0.79840700 0.25577400 1.0 I I17 1 0.29840700 0.70296200 0.75577400 1.0 I I18 1 0.75577400 0.29840700 0.70296200 1.0 I I19 1 0.70296200 0.75577400 0.29840700 1.0 I I20 1 0.99453200 0.70478200 0.39175000 1.0 I I21 1 0.39175000 0.99453200 0.70478200 1.0 I I22 1 0.70478200 0.39175000 0.99453200 1.0 I I23 1 0.89175000 0.20478200 0.49453200 1.0 I I24 1 0.49453200 0.89175000 0.20478200 1.0 I I25 1 0.20478200 0.49453200 0.89175000 1.0 I I26 1 0.91148500 0.51073700 0.53443300 1.0 I I27 1 0.53443300 0.91148500 0.51073700 1.0 I I28 1 0.51073700 0.53443300 0.91148500 1.0 I I29 1 0.03443300 0.01073700 0.41148500 1.0 I I30 1 0.41148500 0.03443300 0.01073700 1.0 I I31 1 0.01073700 0.41148500 0.03443300 1.0 O O32 1 0.04621900 0.98403800 0.90131400 1.0 O O33 1 0.90131400 0.04621900 0.98403800 1.0 O O34 1 0.98403800 0.90131400 0.04621900 1.0 O O35 1 0.40131400 0.48403800 0.54621900 1.0 O O36 1 0.54621900 0.40131400 0.48403800 1.0 O O37 1 0.48403800 0.54621900 0.40131400 1.0 O O38 1 0.90310700 0.86260500 0.64673800 1.0 O O39 1 0.64673800 0.90310700 0.86260500 1.0 O O40 1 0.86260500 0.64673800 0.90310700 1.0 O O41 1 0.14673800 0.36260500 0.40310700 1.0 O O42 1 0.40310700 0.14673800 0.36260500 1.0 O O43 1 0.36260500 0.40310700 0.14673800 1.0 O O44 1 0.82568600 0.00423400 0.75123800 1.0 O O45 1 0.75123800 0.82568600 0.00423400 1.0 O O46 1 0.00423400 0.75123800 0.82568600 1.0 O O47 1 0.25123800 0.50423400 0.32568600 1.0 O O48 1 0.32568600 0.25123800 0.50423400 1.0 O O49 1 0.50423400 0.32568600 0.25123800 1.0 O O50 1 0.72097800 0.88484300 0.50799800 1.0 O O51 1 0.50799800 0.72097800 0.88484300 1.0 O O52 1 0.88484300 0.50799800 0.72097800 1.0 O O53 1 0.00799800 0.38484300 0.22097800 1.0 O O54 1 0.22097700 0.00799800 0.38484300 1.0 O O55 1 0.38484300 0.22097800 0.00799800 1.0 O O56 1 0.13027500 0.05782100 0.74141300 1.0 O O57 1 0.74141300 0.13027500 0.05782100 1.0 O O58 1 0.05782100 0.74141300 0.13027500 1.0 O O59 1 0.24141300 0.55782100 0.63027500 1.0 O O60 1 0.63027500 0.24141300 0.55782100 1.0 O O61 1 0.55782100 0.63027500 0.24141300 1.0 O O62 1 0.20527800 0.21234800 0.66168100 1.0 O O63 1 0.66168100 0.20527800 0.21234800 1.0 O O64 1 0.21234800 0.66168100 0.20527800 1.0 O O65 1 0.16168100 0.71234800 0.70527800 1.0 O O66 1 0.70527800 0.16168100 0.71234800 1.0 O O67 1 0.71234800 0.70527800 0.16168100 1.0 O O68 1 0.21132500 0.29751000 0.87895400 1.0 O O69 1 0.87895400 0.21132500 0.29751000 1.0 O O70 1 0.29751000 0.87895400 0.21132500 1.0 O O71 1 0.37895400 0.79751000 0.71132500 1.0 O O72 1 0.71132500 0.37895400 0.79751000 1.0 O O73 1 0.79751000 0.71132500 0.37895400 1.0 O O74 1 0.09399800 0.83323700 0.54036600 1.0 O O75 1 0.54036600 0.09399800 0.83323700 1.0 O O76 1 0.83323700 0.54036600 0.09399800 1.0 O O77 1 0.04036600 0.33323700 0.59399800 1.0 O O78 1 0.59399800 0.04036600 0.33323700 1.0 O O79 1 0.33323700 0.59399800 0.04036600 1.0 O O80 1 0.10234500 0.66990500 0.35988900 1.0 O O81 1 0.35988900 0.10234500 0.66990500 1.0 O O82 1 0.66990500 0.35988900 0.10234500 1.0 O O83 1 0.85988900 0.16990500 0.60234500 1.0 O O84 1 0.60234500 0.85988900 0.16990500 1.0 O O85 1 0.16990500 0.60234500 0.85988900 1.0 O O86 1 0.98323300 0.78792600 0.31093400 1.0 O O87 1 0.31093400 0.98323300 0.78792600 1.0 O O88 1 0.78792600 0.31093400 0.98323300 1.0 O O89 1 0.81093400 0.28792600 0.48323300 1.0 O O90 1 0.48323300 0.81093400 0.28792600 1.0 O O91 1 0.28792600 0.48323300 0.81093400 1.0 O O92 1 0.93816900 0.66060600 0.56708700 1.0 O O93 1 0.56708700 0.93816900 0.66060600 1.0 O O94 1 0.66060600 0.56708700 0.93816900 1.0 O O95 1 0.06708700 0.16060600 0.43816900 1.0 O O96 1 0.43816900 0.06708700 0.16060600 1.0 O O97 1 0.16060600 0.43816900 0.06708700 1.0 O O98 1 0.75094600 0.44344300 0.45099800 1.0 O O99 1 0.45099800 0.75094600 0.44344300 1.0 O O100 1 0.44344300 0.45099800 0.75094600 1.0 O O101 1 0.95099800 0.94344300 0.25094600 1.0 O O102 1 0.25094600 0.95099800 0.94344300 1.0 O O103 1 0.94344300 0.25094600 0.95099800 1.0 O O104 1 0.94240500 0.47723900 0.40941600 1.0 O O105 1 0.40941600 0.94240500 0.47723900 1.0 O O106 1 0.47723900 0.40941600 0.94240500 1.0 O O107 1 0.90941600 0.97723900 0.44240500 1.0 O O108 1 0.44240500 0.90941600 0.97723900 1.0 O O109 1 0.97723900 0.44240500 0.90941600 1.0