# generated using pymatgen data_BaHo2CuO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.68849900 _cell_length_b 7.20474700 _cell_length_c 12.21924400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaHo2CuO5 _chemical_formula_sum 'Ba4 Ho8 Cu4 O20' _cell_volume 500.79589235 _cell_formula_units_Z 4 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 0.75000000 0.06888900 0.09578200 1.0 Ba Ba1 1 0.75000000 0.43111100 0.59578200 1.0 Ba Ba2 1 0.25000000 0.56888900 0.40421800 1.0 Ba Ba3 1 0.25000000 0.93111100 0.90421800 1.0 Ho Ho4 1 0.25000000 0.39691700 0.07390200 1.0 Ho Ho5 1 0.75000000 0.61347900 0.21299100 1.0 Ho Ho6 1 0.75000000 0.88652100 0.71299100 1.0 Ho Ho7 1 0.25000000 0.11347900 0.28700900 1.0 Ho Ho8 1 0.75000000 0.60308300 0.92609800 1.0 Ho Ho9 1 0.75000000 0.89691700 0.42609800 1.0 Ho Ho10 1 0.25000000 0.10308300 0.57390200 1.0 Ho Ho11 1 0.25000000 0.38652100 0.78700900 1.0 Cu Cu12 1 0.25000000 0.78226400 0.16063600 1.0 Cu Cu13 1 0.75000000 0.21773600 0.83936400 1.0 Cu Cu14 1 0.75000000 0.28226400 0.33936400 1.0 Cu Cu15 1 0.25000000 0.71773600 0.66063600 1.0 O O16 1 0.25000000 0.41464000 0.60018300 1.0 O O17 1 0.75000000 0.58536000 0.39981700 1.0 O O18 1 0.75000000 0.91464000 0.89981700 1.0 O O19 1 0.25000000 0.08536000 0.10018300 1.0 O O20 1 0.00311900 0.85641100 0.27191300 1.0 O O21 1 0.50311900 0.14358900 0.72808700 1.0 O O22 1 0.99688100 0.35641100 0.22808700 1.0 O O23 1 0.49688100 0.64358900 0.77191300 1.0 O O24 1 0.99688100 0.14358900 0.72808700 1.0 O O25 1 0.49688100 0.85641100 0.27191300 1.0 O O26 1 0.00311900 0.64358900 0.77191300 1.0 O O27 1 0.50311900 0.35641100 0.22808700 1.0 O O28 1 0.49492600 0.66091200 0.06805700 1.0 O O29 1 0.99492600 0.33908800 0.93194300 1.0 O O30 1 0.50507400 0.16091200 0.43194300 1.0 O O31 1 0.00507400 0.83908800 0.56805700 1.0 O O32 1 0.99492600 0.16091200 0.43194300 1.0 O O33 1 0.49492600 0.83908800 0.56805700 1.0 O O34 1 0.00507400 0.66091200 0.06805700 1.0 O O35 1 0.50507400 0.33908800 0.93194300 1.0