# generated using pymatgen data_Zr11Sb18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.81834637 _cell_length_b 6.81834618 _cell_length_c 30.62852795 _cell_angle_alpha 96.39066335 _cell_angle_beta 96.39066410 _cell_angle_gamma 90.00000459 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr11Sb18 _chemical_formula_sum 'Zr22 Sb36' _cell_volume 1406.16364442 _cell_formula_units_Z 2 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 0.36295379 0.36295379 0.72590558 1.0 Zr Zr1 1 0.63704621 0.63704621 0.27409442 1.0 Zr Zr2 1 0.38704621 0.88704621 0.77409442 1.0 Zr Zr3 1 0.11295379 0.61295379 0.22590558 1.0 Zr Zr4 1 0.08892588 0.08892588 0.17785176 1.0 Zr Zr5 1 0.91107412 0.91107412 0.82214824 1.0 Zr Zr6 1 0.66107412 0.16107412 0.32214824 1.0 Zr Zr7 1 0.83892588 0.33892588 0.67785176 1.0 Zr Zr8 1 0.00000000 -0.00000000 0.00000000 1.0 Zr Zr9 1 0.75000000 0.25000000 0.50000000 1.0 Zr Zr10 1 0.45204921 0.45204921 0.90409742 1.0 Zr Zr11 1 0.54795079 0.54795079 0.09590258 1.0 Zr Zr12 1 0.29795079 0.79795079 0.59590258 1.0 Zr Zr13 1 0.20204921 0.70204921 0.40409742 1.0 Zr Zr14 1 0.56669284 0.06669284 0.13338768 1.0 Zr Zr15 1 0.93330716 0.43330716 0.86661232 1.0 Zr Zr16 1 0.18330716 0.18330716 0.36661232 1.0 Zr Zr17 1 0.81669284 0.81669284 0.63338768 1.0 Zr Zr18 1 0.27392594 0.27392594 0.54784988 1.0 Zr Zr19 1 0.72607406 0.72607406 0.45215012 1.0 Zr Zr20 1 0.47607406 0.97607406 0.95215012 1.0 Zr Zr21 1 0.02392594 0.52392594 0.04784988 1.0 Sb Sb22 1 0.11520027 0.77676948 0.91535631 1.0 Sb Sb23 1 0.86141317 0.88479973 0.08464369 1.0 Sb Sb24 1 0.22323052 0.19984495 0.08464369 1.0 Sb Sb25 1 0.94984495 0.47323052 0.58464369 1.0 Sb Sb26 1 0.63479973 0.11141317 0.58464369 1.0 Sb Sb27 1 0.80015505 0.13858683 0.91535631 1.0 Sb Sb28 1 0.88858683 0.05015505 0.41535631 1.0 Sb Sb29 1 0.52676948 0.36520027 0.41535631 1.0 Sb Sb30 1 0.90134897 0.40848706 0.13856071 1.0 Sb Sb31 1 0.26992735 0.09865103 0.86143929 1.0 Sb Sb32 1 0.59151294 0.76278826 0.86143929 1.0 Sb Sb33 1 0.51278826 0.84151294 0.36143929 1.0 Sb Sb34 1 0.84865103 0.51992735 0.36143929 1.0 Sb Sb35 1 0.23721174 0.73007265 0.13856071 1.0 Sb Sb36 1 0.48007265 0.48721174 0.63856071 1.0 Sb Sb37 1 0.15848706 0.15134897 0.63856071 1.0 Sb Sb38 1 0.19974784 0.55810637 0.80753493 1.0 Sb Sb39 1 0.75057244 0.80025216 0.19246507 1.0 Sb Sb40 1 0.44189363 0.39221291 0.19246507 1.0 Sb Sb41 1 0.14221291 0.69189363 0.69246507 1.0 Sb Sb42 1 0.55025216 0.00057244 0.69246507 1.0 Sb Sb43 1 0.60778709 0.24942756 0.80753493 1.0 Sb Sb44 1 -0.00057244 0.85778709 0.30753493 1.0 Sb Sb45 1 0.30810637 0.44974784 0.30753493 1.0 Sb Sb46 1 0.67117857 0.23965973 0.03000711 1.0 Sb Sb47 1 0.20965262 0.32882143 0.96999289 1.0 Sb Sb48 1 0.76034027 0.64117146 0.96999289 1.0 Sb Sb49 1 0.39117146 0.01034027 0.46999289 1.0 Sb Sb50 1 0.07882143 0.45965262 0.46999289 1.0 Sb Sb51 1 0.35882854 0.79034738 0.03000711 1.0 Sb Sb52 1 0.54034738 0.60882854 0.53000711 1.0 Sb Sb53 1 0.98965973 0.92117857 0.53000711 1.0 Sb Sb54 1 0.87500000 0.28405692 0.25000000 1.0 Sb Sb55 1 0.03405692 0.12500000 0.75000000 1.0 Sb Sb56 1 0.71594308 0.62500000 0.75000000 1.0 Sb Sb57 1 0.37500000 0.96594308 0.25000000 1.0