# generated using pymatgen data_Ba10Er5Cu15O34 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.61823200 _cell_length_b 8.74531176 _cell_length_c 12.44786585 _cell_angle_alpha 97.76874203 _cell_angle_beta 105.91112000 _cell_angle_gamma 91.10276123 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba10Er5Cu15O34 _chemical_formula_sum 'Ba10 Er5 Cu15 O34' _cell_volume 892.39815230 _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 0.71787600 0.85911100 0.81125200 1.0 Ba Ba1 1 0.32638000 0.66308700 0.81823700 1.0 Ba Ba2 1 0.92722400 0.46363300 0.81799000 1.0 Ba Ba3 1 0.52832300 0.26435000 0.81848700 1.0 Ba Ba4 1 0.13127200 0.06542000 0.81145800 1.0 Ba Ba5 1 0.47167700 0.73565000 0.18151300 1.0 Ba Ba6 1 0.07277600 0.53636700 0.18201000 1.0 Ba Ba7 1 0.67362000 0.33691300 0.18176300 1.0 Ba Ba8 1 0.28212400 0.14088900 0.18874800 1.0 Ba Ba9 1 0.86872800 0.93458000 0.18854200 1.0 Er Er10 1 0.00000000 0.00000000 0.50000000 1.0 Er Er11 1 0.40018300 0.20079500 0.50123500 1.0 Er Er12 1 0.79974400 0.40033200 0.50002700 1.0 Er Er13 1 0.20025600 0.59966800 0.49997300 1.0 Er Er14 1 0.59981700 0.79920500 0.49876500 1.0 Cu Cu15 1 0.95581600 0.72850700 0.64006300 1.0 Cu Cu16 1 0.35676200 0.92813200 0.64108100 1.0 Cu Cu17 1 0.75619300 0.12762400 0.64015600 1.0 Cu Cu18 1 0.15662000 0.32914500 0.64180600 1.0 Cu Cu19 1 0.55674400 0.52773000 0.64179400 1.0 Cu Cu20 1 0.84338000 0.67085500 0.35819400 1.0 Cu Cu21 1 0.24380700 0.87237600 0.35984400 1.0 Cu Cu22 1 0.64323800 0.07186800 0.35891900 1.0 Cu Cu23 1 0.04418400 0.27149300 0.35993700 1.0 Cu Cu24 1 0.44325600 0.47227000 0.35820600 1.0 Cu Cu25 1 0.10576000 0.78847600 0.00002000 1.0 Cu Cu26 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu27 1 0.89424000 0.21152400 0.99998000 1.0 Cu Cu28 1 0.30098200 0.39603100 0.99996000 1.0 Cu Cu29 1 0.69901800 0.60396900 0.00004000 1.0 O O30 1 0.84719100 0.92320700 0.61762000 1.0 O O31 1 0.24744100 0.12395900 0.61972200 1.0 O O32 1 0.64853400 0.32325100 0.61968000 1.0 O O33 1 0.04716900 0.52478700 0.61947000 1.0 O O34 1 0.44805800 0.72402300 0.61924900 1.0 O O35 1 0.75255900 0.87604100 0.38027800 1.0 O O36 1 0.15280900 0.07679300 0.38238000 1.0 O O37 1 0.55194200 0.27597700 0.38075100 1.0 O O38 1 0.95283100 0.47521300 0.38053000 1.0 O O39 1 0.35146600 0.67674900 0.38032000 1.0 O O40 1 0.03183300 0.78276300 0.84790600 1.0 O O41 1 0.43617500 0.96807800 0.84034500 1.0 O O42 1 0.84661400 0.15634300 0.84790900 1.0 O O43 1 0.23745900 0.36711000 0.84030000 1.0 O O44 1 0.63486700 0.56895800 0.84019500 1.0 O O45 1 0.76254100 0.63289000 0.15970000 1.0 O O46 1 0.15338600 0.84365700 0.15209100 1.0 O O47 1 0.56382500 0.03192200 0.15965500 1.0 O O48 1 0.96816700 0.21723700 0.15209400 1.0 O O49 1 0.36513300 0.43104200 0.15980500 1.0 O O50 1 0.14704500 0.82358900 0.61789000 1.0 O O51 1 0.54691700 0.02346000 0.61779700 1.0 O O52 1 0.94763400 0.22383500 0.61793100 1.0 O O53 1 0.34708100 0.42365700 0.61780400 1.0 O O54 1 0.74707800 0.62347200 0.61792100 1.0 O O55 1 0.05236600 0.77616500 0.38206900 1.0 O O56 1 0.45308300 0.97654000 0.38220300 1.0 O O57 1 0.85295500 0.17641100 0.38211000 1.0 O O58 1 0.25292200 0.37652800 0.38207900 1.0 O O59 1 0.65291900 0.57634300 0.38219600 1.0 O O60 1 0.60002900 0.80697600 0.99998300 1.0 O O61 1 0.20572400 0.58777100 0.99993300 1.0 O O62 1 0.79427600 0.41222900 0.00006700 1.0 O O63 1 0.39997100 0.19302400 0.00001700 1.0