# generated using pymatgen data_BaCdO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.69197323 _cell_length_b 6.19970638 _cell_length_c 12.02174781 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaCdO2 _chemical_formula_sum 'Ba4 Cd4 O8' _cell_volume 275.16758875 _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 0.25000000 0.39616042 0.35759863 1.0 Ba Ba1 1 0.75000000 0.60383958 0.64240137 1.0 Ba Ba2 1 0.25000000 0.89616042 0.14240137 1.0 Ba Ba3 1 0.75000000 0.10383958 0.85759863 1.0 Cd Cd4 1 0.75000000 0.90593269 0.39311423 1.0 Cd Cd5 1 0.75000000 0.40593269 0.10688577 1.0 Cd Cd6 1 0.25000000 0.09406731 0.60688577 1.0 Cd Cd7 1 0.25000000 0.59406731 0.89311423 1.0 O O8 1 0.25000000 0.28068468 0.01809904 1.0 O O9 1 0.75000000 0.71931532 0.98190096 1.0 O O10 1 0.25000000 0.78068468 0.48190096 1.0 O O11 1 0.75000000 0.21931532 0.51809904 1.0 O O12 1 0.25000000 0.85592964 0.74885515 1.0 O O13 1 0.75000000 0.64407036 0.24885515 1.0 O O14 1 0.25000000 0.35592964 0.75114485 1.0 O O15 1 0.75000000 0.14407036 0.25114485 1.0