# generated using pymatgen data_Zr18Nb7RuO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.79582751 _cell_length_b 8.72200009 _cell_length_c 8.60333253 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.28040463 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr18Nb7RuO6 _chemical_formula_sum 'Zr18 Nb7 Ru1 O6' _cell_volume 569.97534020 _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 Zr Zr0 1 0.45351325 0.90702650 0.25000000 1.0 Zr Zr1 1 0.54564573 0.09129146 0.75000000 1.0 Zr Zr2 1 0.09200985 0.54432201 0.25000000 1.0 Zr Zr3 1 0.90816168 0.45388565 0.75000000 1.0 Zr Zr4 1 0.45231216 0.54432201 0.25000000 1.0 Zr Zr5 1 0.54572496 0.45388565 0.75000000 1.0 Zr Zr6 1 0.20769495 0.41538990 0.56264621 1.0 Zr Zr7 1 0.79136944 0.58273888 0.43798251 1.0 Zr Zr8 1 0.58323864 0.79046459 0.56098896 1.0 Zr Zr9 1 0.79136944 0.58273888 0.06201749 1.0 Zr Zr10 1 0.41425122 0.20645666 0.43922955 1.0 Zr Zr11 1 0.20769495 0.41538990 0.93735379 1.0 Zr Zr12 1 0.20722595 0.79046459 0.56098896 1.0 Zr Zr13 1 0.41425122 0.20645666 0.06077045 1.0 Zr Zr14 1 0.79220545 0.20645666 0.43922955 1.0 Zr Zr15 1 0.58323864 0.79046459 0.93901104 1.0 Zr Zr16 1 0.79220545 0.20645666 0.06077045 1.0 Zr Zr17 1 0.20722595 0.79046459 0.93901104 1.0 Nb Nb18 1 0.88837766 0.77675632 0.75000000 1.0 Nb Nb19 1 0.78039350 0.89449613 0.25000000 1.0 Nb Nb20 1 0.22294783 0.11152967 0.75000000 1.0 Nb Nb21 1 0.11410364 0.89449613 0.25000000 1.0 Nb Nb22 1 0.88858184 0.11152967 0.75000000 1.0 Nb Nb23 1 0.00264118 0.00528136 0.00396440 1.0 Nb Nb24 1 0.00264118 0.00528136 0.49603560 1.0 Ru Ru25 1 0.11506958 0.23013916 0.25000000 1.0 O O26 1 0.50042129 0.00084258 0.00055331 1.0 O O27 1 0.00093454 0.49753155 0.00193832 1.0 O O28 1 0.50042129 0.00084258 0.49944669 1.0 O O29 1 0.49659701 0.49753155 0.00193832 1.0 O O30 1 0.00093454 0.49753155 0.49806168 1.0 O O31 1 0.49659701 0.49753155 0.49806168 1.0