# generated using pymatgen data_Zr6Zn21CoNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63022964 _cell_length_b 8.62382437 _cell_length_c 8.62382538 _cell_angle_alpha 59.79588699 _cell_angle_beta 59.97542444 _cell_angle_gamma 59.97543024 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Zn21CoNi2 _chemical_formula_sum 'Zr6 Zn21 Co1 Ni2' _cell_volume 452.97255286 _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 0.70238341 0.29761659 0.29761659 1.0 Zr Zr1 1 0.29761659 0.70238341 0.70238341 1.0 Zr Zr2 1 0.29767849 0.69931193 0.30068807 1.0 Zr Zr3 1 0.70232151 0.30068807 0.69931193 1.0 Zr Zr4 1 0.29767849 0.30068807 0.69931193 1.0 Zr Zr5 1 0.70232151 0.69931193 0.30068807 1.0 Zn Zn6 1 0.11680718 0.11801993 0.11801993 1.0 Zn Zn7 1 0.88319282 0.88198007 0.88198007 1.0 Zn Zn8 1 0.11362578 0.12820330 0.64454614 1.0 Zn Zn9 1 0.11362578 0.64454614 0.12820330 1.0 Zn Zn10 1 0.88637422 0.87179670 0.35545386 1.0 Zn Zn11 1 0.88637422 0.35545386 0.87179670 1.0 Zn Zn12 1 0.64715595 0.11801993 0.11801993 1.0 Zn Zn13 1 0.35284405 0.88198007 0.88198007 1.0 Zn Zn14 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn15 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn16 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn17 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn18 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn19 1 0.32288221 0.33383080 0.33383080 1.0 Zn Zn20 1 0.67711779 0.66616920 0.66616920 1.0 Zn Zn21 1 0.33020443 0.33013420 0.00945793 1.0 Zn Zn22 1 0.33020443 0.00945793 0.33013420 1.0 Zn Zn23 1 0.66979557 0.66986580 0.99054207 1.0 Zn Zn24 1 0.66979557 0.99054207 0.66986580 1.0 Zn Zn25 1 0.00945720 0.33383080 0.33383080 1.0 Zn Zn26 1 0.99054280 0.66616920 0.66616920 1.0 Co Co27 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni28 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni29 1 0.00000000 0.00000000 0.00000000 1.0