# generated using pymatgen data_BaErMn2O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.60965800 _cell_length_b 5.60965800 _cell_length_c 7.81885600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaErMn2O5 _chemical_formula_sum 'Ba2 Er2 Mn4 O10' _cell_volume 246.04581601 _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 0.00000000 0.00000000 0.00000000 1.0 Ba Ba1 1 0.50000000 0.50000000 0.00000000 1.0 Er Er2 1 0.00000000 0.00000000 0.50000000 1.0 Er Er3 1 0.50000000 0.50000000 0.50000000 1.0 Mn Mn4 1 0.00000000 0.50000000 0.25864700 1.0 Mn Mn5 1 0.50000000 0.00000000 0.74135300 1.0 Mn Mn6 1 0.00000000 0.50000000 0.72353900 1.0 Mn Mn7 1 0.50000000 0.00000000 0.27646100 1.0 O O8 1 0.24399000 0.74399000 0.67791400 1.0 O O9 1 0.75601000 0.74399000 0.67791400 1.0 O O10 1 0.24399000 0.25601000 0.67791400 1.0 O O11 1 0.75601000 0.25601000 0.67791400 1.0 O O12 1 0.25601000 0.75601000 0.32208600 1.0 O O13 1 0.74399000 0.75601000 0.32208600 1.0 O O14 1 0.25601000 0.24399000 0.32208600 1.0 O O15 1 0.74399000 0.24399000 0.32208600 1.0 O O16 1 0.00000000 0.50000000 0.99377900 1.0 O O17 1 0.50000000 0.00000000 0.00622100 1.0