# generated using pymatgen data_RbBa(LaB12)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.29225183 _cell_length_b 7.29225134 _cell_length_c 5.94580417 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 109.47027542 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbBa(LaB12)2 _chemical_formula_sum 'Rb1 Ba1 La2 B24' _cell_volume 298.09875345 _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 Rb Rb0 1 0.75114176 0.24885824 0.50000000 1.0 Ba Ba1 1 0.99744369 0.00255631 0.00000000 1.0 La La2 1 0.50259509 0.49740491 0.00000000 1.0 La La3 1 0.24972717 0.75027283 0.50000000 1.0 B B4 1 0.17851783 0.32742430 0.64805702 1.0 B B5 1 0.92691990 0.57482757 0.14920873 1.0 B B6 1 0.67257570 0.82148217 0.64805702 1.0 B B7 1 0.42517243 0.07308010 0.14920873 1.0 B B8 1 0.17851783 0.32742430 0.35194298 1.0 B B9 1 0.92691990 0.57482757 0.85079127 1.0 B B10 1 0.67257570 0.82148217 0.35194298 1.0 B B11 1 0.42517243 0.07308010 0.85079127 1.0 B B12 1 0.40110249 0.39828993 0.50000000 1.0 B B13 1 0.14909732 0.65043531 0.00000000 1.0 B B14 1 0.89650703 0.89829308 0.50000000 1.0 B B15 1 0.64724424 0.14729291 0.00000000 1.0 B B16 1 0.32518603 0.17637339 0.64819839 1.0 B B17 1 0.07689707 0.42916584 0.14905561 1.0 B B18 1 0.82362661 0.67481397 0.64819839 1.0 B B19 1 0.57083416 0.92310293 0.14905561 1.0 B B20 1 0.10170692 0.10349297 0.50000000 1.0 B B21 1 0.85270709 0.35275576 0.00000000 1.0 B B22 1 0.60171007 0.59889751 0.50000000 1.0 B B23 1 0.34956469 0.85090268 0.00000000 1.0 B B24 1 0.32518603 0.17637339 0.35180161 1.0 B B25 1 0.07689707 0.42916584 0.85094439 1.0 B B26 1 0.82362661 0.67481397 0.35180161 1.0 B B27 1 0.57083416 0.92310293 0.85094439 1.0