# generated using pymatgen data_BaSr3Pd2(OF)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.12893200 _cell_length_b 4.12893200 _cell_length_c 13.30505600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSr3Pd2(OF)4 _chemical_formula_sum 'Ba1 Sr3 Pd2 O4 F4' _cell_volume 226.82565192 _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 Ba Ba0 1 0.50000000 0.50000000 0.13618600 1.0 Sr Sr1 1 0.00000000 0.00000000 0.63846600 1.0 Sr Sr2 1 0.00000000 0.00000000 0.37079200 1.0 Sr Sr3 1 0.50000000 0.50000000 0.85767200 1.0 Pd Pd4 1 0.00000000 0.00000000 0.00394000 1.0 Pd Pd5 1 0.50000000 0.50000000 0.50117700 1.0 O O6 1 0.50000000 0.00000000 0.98297100 1.0 O O7 1 0.00000000 0.50000000 0.50515100 1.0 O O8 1 0.00000000 0.50000000 0.98297100 1.0 O O9 1 0.50000000 0.00000000 0.50515100 1.0 F F10 1 0.00000000 0.50000000 0.26200400 1.0 F F11 1 0.50000000 0.00000000 0.74575800 1.0 F F12 1 0.50000000 0.00000000 0.26200400 1.0 F F13 1 0.00000000 0.50000000 0.74575800 1.0