# generated using pymatgen data_YCu6ClO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.57084492 _cell_length_b 6.57084492 _cell_length_c 6.57084492 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YCu6ClO8 _chemical_formula_sum 'Y1 Cu6 Cl1 O8' _cell_volume 200.60818754 _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 Y Y0 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu1 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu2 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu3 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu4 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu5 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu6 1 0.50000000 0.00000000 0.00000000 1.0 Cl Cl7 1 0.50000000 0.50000000 0.50000000 1.0 O O8 1 0.85550300 0.85550300 0.43349100 1.0 O O9 1 0.85550300 0.43349100 0.85550300 1.0 O O10 1 0.43349100 0.85550300 0.85550300 1.0 O O11 1 0.85550300 0.85550300 0.85550300 1.0 O O12 1 0.14449700 0.14449700 0.56650900 1.0 O O13 1 0.14449700 0.56650900 0.14449700 1.0 O O14 1 0.56650900 0.14449700 0.14449700 1.0 O O15 1 0.14449700 0.14449700 0.14449700 1.0