# generated using pymatgen data_K2Zr7Cl18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.29677003 _cell_length_b 10.26279925 _cell_length_c 10.26370392 _cell_angle_alpha 55.36379651 _cell_angle_beta 55.40811527 _cell_angle_gamma 55.57288981 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2Zr7Cl18 _chemical_formula_sum 'K2 Zr7 Cl18' _cell_volume 685.85500066 _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 K K0 1 0.77756956 0.77570747 0.77566923 1.0 K K1 1 0.22367588 0.22324565 0.22498124 1.0 Zr Zr2 1 0.50146139 0.50108894 0.49872802 1.0 Zr Zr3 1 0.16595973 0.78595071 0.89980574 1.0 Zr Zr4 1 0.89668078 0.16412718 0.79204866 1.0 Zr Zr5 1 0.78892040 0.90657079 0.15912690 1.0 Zr Zr6 1 0.83416617 0.21173972 0.09808267 1.0 Zr Zr7 1 0.10212242 0.83410467 0.21342961 1.0 Zr Zr8 1 0.21318229 0.09845670 0.83686091 1.0 Cl Cl9 1 0.36025445 0.51989699 0.78446275 1.0 Cl Cl10 1 0.78199930 0.36115007 0.52205303 1.0 Cl Cl11 1 0.52203468 0.78363813 0.35972242 1.0 Cl Cl12 1 0.63734220 0.48008479 0.21606119 1.0 Cl Cl13 1 0.21613887 0.63787628 0.48060637 1.0 Cl Cl14 1 0.47906769 0.21613426 0.63860186 1.0 Cl Cl15 1 0.13474711 0.28293182 0.57359973 1.0 Cl Cl16 1 0.57014885 0.13585774 0.28571693 1.0 Cl Cl17 1 0.28413853 0.56973004 0.13661171 1.0 Cl Cl18 1 0.05842137 0.34834741 0.93286249 1.0 Cl Cl19 1 0.35016243 0.93260681 0.05911897 1.0 Cl Cl20 1 0.93293363 0.05792623 0.34886860 1.0 Cl Cl21 1 0.94428740 0.64793240 0.07184028 1.0 Cl Cl22 1 0.64636191 0.07120374 0.94246992 1.0 Cl Cl23 1 0.07180779 0.94395840 0.64766469 1.0 Cl Cl24 1 0.71053741 0.42992286 0.86602703 1.0 Cl Cl25 1 0.42701458 0.86794085 0.70997310 1.0 Cl Cl26 1 0.86886320 0.71186835 0.42500695 1.0