# generated using pymatgen data_Ba10Gd3Y2(Cu3O7)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.85692026 _cell_length_b 19.62160803 _cell_length_c 11.87861246 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba10Gd3Y2(Cu3O7)5 _chemical_formula_sum 'Ba10 Gd3 Y2 Cu15 O35' _cell_volume 898.96124562 _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 Ba Ba0 1 0.50000000 0.09991748 0.17925385 1.0 Ba Ba1 1 0.50000000 0.30007063 0.17977789 1.0 Ba Ba2 1 0.50000000 0.49992937 0.17977789 1.0 Ba Ba3 1 0.50000000 0.70008252 0.17925385 1.0 Ba Ba4 1 0.50000000 0.90000000 0.17897959 1.0 Ba Ba5 1 0.50000000 0.09991748 0.82074615 1.0 Ba Ba6 1 0.50000000 0.30007063 0.82022211 1.0 Ba Ba7 1 0.50000000 0.49992937 0.82022211 1.0 Ba Ba8 1 0.50000000 0.70008252 0.82074615 1.0 Ba Ba9 1 0.50000000 0.90000000 0.82102041 1.0 Gd Gd10 1 0.50000000 0.10040369 0.50000000 1.0 Gd Gd11 1 0.50000000 0.69959631 0.50000000 1.0 Gd Gd12 1 0.50000000 0.90000000 0.50000000 1.0 Y Y13 1 0.50000000 0.30025783 0.50000000 1.0 Y Y14 1 0.50000000 0.49974217 0.50000000 1.0 Cu Cu15 1 0.00000000 0.00016933 0.35070698 1.0 Cu Cu16 1 0.00000000 0.20061327 0.35110386 1.0 Cu Cu17 1 0.00000000 0.40000000 0.35211286 1.0 Cu Cu18 1 0.00000000 0.59938673 0.35110386 1.0 Cu Cu19 1 0.00000000 0.79983067 0.35070698 1.0 Cu Cu20 1 0.00000000 0.00016933 0.64929302 1.0 Cu Cu21 1 0.00000000 0.20061327 0.64889614 1.0 Cu Cu22 1 0.00000000 0.40000000 0.64788714 1.0 Cu Cu23 1 0.00000000 0.59938673 0.64889614 1.0 Cu Cu24 1 0.00000000 0.79983067 0.64929302 1.0 Cu Cu25 1 0.00000000 0.00006968 0.00000000 1.0 Cu Cu26 1 0.00000000 0.20012981 0.00000000 1.0 Cu Cu27 1 0.00000000 0.40000000 0.00000000 1.0 Cu Cu28 1 0.00000000 0.59987019 0.00000000 1.0 Cu Cu29 1 0.00000000 0.79993032 0.00000000 1.0 O O30 1 0.00000000 0.99997229 0.15877320 1.0 O O31 1 0.00000000 0.20012518 0.15886992 1.0 O O32 1 0.00000000 0.40000000 0.15895923 1.0 O O33 1 0.00000000 0.59987482 0.15886992 1.0 O O34 1 0.00000000 0.80002771 0.15877320 1.0 O O35 1 0.00000000 0.99997229 0.84122680 1.0 O O36 1 0.00000000 0.20012518 0.84113008 1.0 O O37 1 0.00000000 0.40000000 0.84104077 1.0 O O38 1 0.00000000 0.59987482 0.84113008 1.0 O O39 1 0.00000000 0.80002771 0.84122680 1.0 O O40 1 0.00000000 0.10044960 0.37577453 1.0 O O41 1 0.00000000 0.30039860 0.37850408 1.0 O O42 1 0.00000000 0.49960140 0.37850408 1.0 O O43 1 0.00000000 0.69955040 0.37577453 1.0 O O44 1 0.00000000 0.90000000 0.37579062 1.0 O O45 1 0.00000000 0.10044960 0.62422547 1.0 O O46 1 0.00000000 0.30039860 0.62149592 1.0 O O47 1 0.00000000 0.49960140 0.62149592 1.0 O O48 1 0.00000000 0.69955040 0.62422547 1.0 O O49 1 0.00000000 0.90000000 0.62420938 1.0 O O50 1 0.00000000 0.10006773 0.00000000 1.0 O O51 1 0.00000000 0.30008818 0.00000000 1.0 O O52 1 0.00000000 0.49991182 0.00000000 1.0 O O53 1 0.00000000 0.69993227 0.00000000 1.0 O O54 1 0.00000000 0.90000000 0.00000000 1.0 O O55 1 0.50000000 0.00025089 0.37730075 1.0 O O56 1 0.50000000 0.20138861 0.37853390 1.0 O O57 1 0.50000000 0.40000000 0.37978730 1.0 O O58 1 0.50000000 0.59861139 0.37853390 1.0 O O59 1 0.50000000 0.79974911 0.37730075 1.0 O O60 1 0.50000000 0.00025089 0.62269925 1.0 O O61 1 0.50000000 0.20138861 0.62146610 1.0 O O62 1 0.50000000 0.40000000 0.62021270 1.0 O O63 1 0.50000000 0.59861139 0.62146610 1.0 O O64 1 0.50000000 0.79974911 0.62269925 1.0