data_image0 _chemical_formula_structural TlNbO3RbNbO3RbNbO3TlNbO3 _chemical_formula_sum "Tl2 Nb4 O12 Rb2" _cell_length_a 5.926537323426607 _cell_length_b 5.926537323426607 _cell_length_c 8.38138946070025 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 90.0 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz '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 Tl Tl1 1.0 0.9933712802825104 0.9933712802825104 0.995267953555602 1.0000 Nb Nb1 1.0 0.48779461059631873 0.9878182690495059 0.23919942050798107 1.0000 O O1 1.0 0.5036514113662185 0.0024075056268432825 0.005928090297531506 1.0000 O O2 1.0 0.2531430381458634 0.2531430381458634 0.2542971922721307 1.0000 O O3 1.0 0.25484916966469234 0.7541934543163021 0.25391416577304077 1.0000 Rb Rb1 1.0 0.4950879628512762 0.4950879628512762 0.9972374722789963 1.0000 Nb Nb2 1.0 0.9878182690495062 0.48779461059631907 0.23919942050798107 1.0000 O O4 1.0 0.002407505626841555 0.5036514113662165 0.0059280902975315 1.0000 O O5 1.0 0.7510979508292136 0.7510979508292136 0.2524993928341918 1.0000 O O6 1.0 0.754193454316302 0.25484916966469223 0.25391416577304077 1.0000 Rb Rb2 1.0 0.9950780465098537 0.9950780465098537 0.4972572864600266 1.0000 Nb Nb3 1.0 0.4883275056035477 0.9883903112059855 0.7392244262374176 1.0000 O O7 1.0 0.5024849342722749 0.0036525685051118782 0.5058609875532297 1.0000 O O8 1.0 0.2517303559484726 0.2517303559484726 0.7527265662396995 1.0000 O O9 1.0 0.2546216535194942 0.7551677409786584 0.7538962295886739 1.0000 Tl Tl2 1.0 0.4932700526895487 0.4932700526895487 0.4952709808241147 1.0000 Nb Nb4 1.0 0.9883903112059839 0.4883275056035458 0.7392244262374176 1.0000 O O10 1.0 0.0036525685051109757 0.502484934272274 0.5058609875532297 1.0000 O O11 1.0 0.7537076009297792 0.7537076009297792 0.7545572480807412 1.0000 O O12 1.0 0.7551677409786584 0.2546216535194942 0.7538962295886739 1.0000