# generated using pymatgen data_BaLaMnRuO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.77729700 _cell_length_b 5.78197600 _cell_length_c 9.90925895 _cell_angle_alpha 54.94186919 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaLaMnRuO6 _chemical_formula_sum 'Ba2 La2 Mn2 Ru2 O12' _cell_volume 270.95540253 _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 0.74853900 0.25055900 0.24910200 1.0 Ba Ba1 1 0.25146100 0.25055900 0.74910200 1.0 La La2 1 0.23920000 0.73270500 0.24914000 1.0 La La3 1 0.76080000 0.73270500 0.74914000 1.0 Mn Mn4 1 0.25257500 0.99843300 0.49704300 1.0 Mn Mn5 1 0.74742500 0.99843300 0.99704300 1.0 Ru Ru6 1 0.25044600 0.50159800 0.99901900 1.0 Ru Ru7 1 0.74955400 0.50159800 0.49901900 1.0 O O8 1 0.24039100 0.78718400 0.75958100 1.0 O O9 1 0.98059000 0.71234700 0.54166000 1.0 O O10 1 0.99204300 0.31249500 0.96266700 1.0 O O11 1 0.00795700 0.31249500 0.46266700 1.0 O O12 1 0.01941000 0.71234700 0.04166000 1.0 O O13 1 0.75960900 0.78718400 0.25958100 1.0 O O14 1 0.74899200 0.16370700 0.73902400 1.0 O O15 1 0.51392400 0.32431600 0.95913000 1.0 O O16 1 0.52620000 0.71665600 0.54363400 1.0 O O17 1 0.47380000 0.71665600 0.04363400 1.0 O O18 1 0.48607600 0.32431600 0.45913000 1.0 O O19 1 0.25100800 0.16370700 0.23902400 1.0