# generated using pymatgen data_BaLaMn2O6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.49801844 _cell_length_b 5.49802839 _cell_length_c 8.16192717 _cell_angle_alpha 90.00875788 _cell_angle_beta 90.00908362 _cell_angle_gamma 89.97497389 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaLaMn2O6 _chemical_formula_sum 'Ba2 La2 Mn4 O12' _cell_volume 246.72083931 _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 Ba Ba0 1 0.50000100 0.00000000 0.74999600 1.0 Ba Ba1 1 0.99999900 0.50000000 0.25000400 1.0 La La2 1 0.49999900 0.99999900 0.24999900 1.0 La La3 1 0.00000100 0.50000000 0.75000200 1.0 Mn Mn4 1 0.50000800 0.49999000 0.49999900 1.0 Mn Mn5 1 0.49999000 0.50001000 0.00000000 1.0 Mn Mn6 1 0.00001100 0.99999000 0.99999900 1.0 Mn Mn7 1 0.99999000 0.00001000 0.50000000 1.0 O O8 1 0.74999900 0.74999900 0.00000000 1.0 O O9 1 0.24999700 0.24999600 0.50000000 1.0 O O10 1 0.25000100 0.25000100 0.00000100 1.0 O O11 1 0.75000300 0.75000400 0.50000000 1.0 O O12 1 0.50000000 0.50000000 0.75002000 1.0 O O13 1 0.00000000 0.00000000 0.25000700 1.0 O O14 1 0.50000000 0.49999900 0.24998000 1.0 O O15 1 0.00000000 0.00000000 0.74999300 1.0 O O16 1 0.74999500 0.25000400 0.00000000 1.0 O O17 1 0.24999400 0.75000600 0.50000000 1.0 O O18 1 0.25000500 0.74999500 0.00000000 1.0 O O19 1 0.75000600 0.24999400 0.50000000 1.0